Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.46 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.46 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| 1,3-Dimethoxybenzene SCHEMBL2348353 | 0.86 | ACHE (0.58) | ACHECES2CES1ENPP2CYP3A4 | |
| SCHEMBL8402770 | 0.83 | CYP1A2 (0.56) | CYP3A4ALDH1A1LMNANPC1RAB9A | |
| SCHEMBL30238353 | 0.82 | ACHE (0.54) | ACHECES2CES1ENPP2CYP3A4 | |
| SCHEMBL22274 | 0.82 | ACHE (0.54) | ACHECES2CES1ENPP2CYP3A4 | |
| SCHEMBL16303509 | 0.81 | ALDH1A1 (0.58) | CYP3A4CA1CA2ALDH1A1NPC1 | |
| SCHEMBL20413238 | 0.81 | ABL1 (0.56) | CYP3A4MAOBCYP1A1CYP1A2CYP2E1 | |
| 1,3-Dimethoxybenzene SCHEMBL27700724 | 0.81 | ACHE (0.64) | ACHECES2CES1ENPP2CYP3A4 | |
| 1,3-Dimethoxybenzene SCHEMBL901285 | 0.81 | ACHE (0.70) | ACHECES2CES1ENPP2CYP3A4 | |
| 1,3-Dimethoxybenzene SCHEMBL9350 | 0.81 | ACHE (0.70) | ACHECES2CES1ENPP2CYP3A4 | |
| SCHEMBL11885381 | 0.78 | ACHE (0.56) | ACHEALDH1A1LMNAMAOB |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113004194-B | Circular polarization luminescent organic micro-nano crystal material and preparation method and application thereof | 中国科学院化学研究所 | 2022-12-09 | — | — | CN | claimed |
| US-12024536-B2 | C-terminal HSP90 inhibitors | UNIVERSITY OF KANSAS (US) | 2024-07-02 | — | — | US | disclosed |
| US-20240018103-A1 | 3-HYDROXYOXINDOLE DERIVATIVES AS CRHR2 ANTAGONIST | RAQUALIA PHARMA INC. (JP) | 2024-01-18 | — | — | US | disclosed |
| CN-114656397-B | Compound, two-dimensional organic crystal containing compound, preparation method and application | 中国科学院化学研究所 | 2023-07-25 | — | — | CN | disclosed |
| CN-113004194-B | Circular polarization luminescent organic micro-nano crystal material and preparation method and application thereof | 中国科学院化学研究所 | 2022-12-09 | — | — | CN | disclosed |
| CN-113004194-A | Circular polarization luminescent organic micro-nano crystal material and preparation method and application thereof | 中国科学院化学研究所 | 2021-06-22 | — | — | CN | disclosed |
| US-20180212158-A1 | ORGANIC LIGHT-EMITTING DIODE MATERIALS | PRESIDENT AND FELLOWS OF HARVARD COLLEGE | 2018-07-26 | — | — | US | disclosed |
| US-10030041-B2 | C-terminal Hsp90 inhibitors | UNIVERSITY OF KANSAS (US) | 2018-07-24 | — | — | US | disclosed |
| US-9997712-B2 | Organic electroluminescent materials and devices | UNIVERSAL DISPLAY CORPORATION (US) | 2018-06-12 | — | — | US | disclosed |
| US-20180118707-A1 | BETA-NAPHTHOISOFLAVONES, COMPOSITIONS CONTAINING, AND USES OF, SAME | THESAN PHARMACEUTICALS, INC. (US) | 2018-05-03 | — | — | US | disclosed |
| US-20130012434-A1 | NOVEL SPIRO IMIDAZOLONES AS GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE | MERCK SHARP & DOHME CORP. | 2013-01-10 | — | — | US | disclosed |
| US-20130001538-A1 | Triphenylene Hosts in Phosphorescent Light Emitting Diodes | UNIVERSAL DISPLAY CORPORATION (US) | 2013-01-03 | — | — | US | disclosed |
| US-8283360-B2 | Bicyclic heterocyclic derivatives and methods of use thereof | MERCK SHARP & DOHME CORP. (US) | 2012-10-09 | — | — | US | disclosed |
| US-20120129852-A1 | AZAINDAZOLES AS KINASE INHIBITORS AND USE THEREOF | BRISTOL-MYERS SQUIBB COMPANY | 2012-05-24 | — | — | US | disclosed |
| US-20120092608-A1 | POLYMERIZABLE COMPOUND AND LIQUID CRYSTAL COMPOSITION INCLUDING IT | JNC PETROCHEMICAL CORPORATION (JP) | 2012-04-19 | — | — | US | disclosed |
| US-20120032156-A1 | Triphenylene Hosts in Phosphorescent Light Emitting Diodes | UNIVERSAL DISPLAY CORPORATION | 2012-02-09 | — | — | US | disclosed |
| US-20110319434-A1 | Bicyclic Heterocyclic Derivatives and Methods of Use Thereof | SCHERING PLOUGH CORPORATION (US) | 2011-12-29 | — | — | US | disclosed |
| US-20110108814-A1 | POLYMER COMPOUND, NET-LIKE POLYMER COMPOUND PRODUCED BY CROSSLINKING THE POLYMER COMPOUND, COMPOSITION FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, ORGANIC ELECTROLUMINESCENCE ELEMENT, ORGANIC EL DISPLAY, AND ORGANIC EL LIGHTING | MITSUBISHI CHEMICAL CORPORATION (JP) | 2011-05-12 | — | — | US | disclosed |
| US-20110105457-A1 | HETEROCYCLIC COMPOUND HAVING INHIBITORY ACTIVITY ON PI3K | SHIONOGI & CO., LTD. | 2011-05-05 | — | — | US | disclosed |
| US-20110021771-A1 | INHIBITORS OF HISTONE DEACETYLASE | METHYLGENE INC. (CA) | 2011-01-27 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20110021771-A1 | INHIBITORS OF HISTONE DEACETYLASE | HDAC1, HDAC11, HDAC3 | ACHE 1157/4885CES2 998/4885CES1 477/4885 |
| US-20240018103-A1 | 3-HYDROXYOXINDOLE DERIVATIVES AS CRHR2 ANTAGONIST | CRHR2, CRHR1, CRH | ACHE 4652/4885CES2 2186/4885CES1 1763/4885 |
| US-20120129852-A1 | AZAINDAZOLES AS KINASE INHIBITORS AND USE THEREOF | BTK, ABL1, JAK1 | ACHE 2890/4885CES2 2687/4885CES1 1630/4885 |
| US-20180212158-A1 | ORGANIC LIGHT-EMITTING DIODE MATERIALS | MSN, DDT, NECTIN4 | ACHE 1237/4885CES2 2529/4885CES1 3777/4885 |
| US-20110319434-A1 | Bicyclic Heterocyclic Derivatives and Methods of Use Thereof | GPR119, GID4, TLR4 | ACHE 501/4885CES2 460/4885CES1 336/4885 |
| US-20180118707-A1 | BETA-NAPHTHOISOFLAVONES, COMPOSITIONS CONTAINING, AND USES OF, SAME | AHR, ARNT, NR1H2 | ACHE 2933/4885CES2 904/4885CES1 232/4885 |
| US-20110105457-A1 | HETEROCYCLIC COMPOUND HAVING INHIBITORY ACTIVITY ON PI3K | MTOR, STAT3, PIK3CD | ACHE 4163/4885CES2 3647/4885CES1 2936/4885 |
| US-20130012434-A1 | NOVEL SPIRO IMIDAZOLONES AS GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE | GLP1R, GCGR, GIPR | ACHE 4453/4885CES2 3753/4885CES1 723/4885 |
| US-10030041-B2 | C-terminal Hsp90 inhibitors | HSP90AB2P, HSP90AB1, HSP90B1 | ACHE 4281/4885CES2 3641/4885CES1 3799/4885 |
| US-12024536-B2 | C-terminal HSP90 inhibitors | HSP90AB2P, HSP90AB1, HSP90B1 | ACHE 4281/4885CES2 3641/4885CES1 3799/4885 |
| US-20120092608-A1 | POLYMERIZABLE COMPOUND AND LIQUID CRYSTAL COMPOSITION INCLUDING IT | KLK3, PDE7A, FZD7 | ACHE 3013/4885CES2 4100/4885CES1 4615/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.