Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 6/20 | 0.37 |
| ▸ | BCHE | P06276 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NSD2 | O96028 | 1/20 | 0.35 |
| ▸ | CTSD | P07339 | 1/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2013877 | 0.75 | NPC1 (0.55) | NPC1HPGDRAB9ASMN1; SMN2TRPA1 | |
| SCHEMBL5008184 | 0.75 | NPC1 (0.55) | NPC1HPGDRAB9ASMN1; SMN2TRPA1 | |
| SCHEMBL2013879 | 0.75 | NPC1 (0.55) | NPC1HPGDRAB9ASMN1; SMN2TRPA1 | |
| SCHEMBL8340986 | 0.75 | NPSR1 (0.40) | NPC1HPGDRAB9ASMN1; SMN2MEN1 | |
| SCHEMBL11799686 | 0.75 | NPC1 (0.50) | NPC1HPGDRAB9ASMN1; SMN2TRPA1 | |
| SCHEMBL16452796 | 0.74 | NPC1 (0.46) | NPC1HPGDRAB9ASMN1; SMN2SIGMAR1 | |
| Hydrochloric Acid SCHEMBL5010650 | 0.73 | NPC1 (0.58) | NPC1HPGDRAB9ASMN1; SMN2TRPA1 | |
| SCHEMBL5139855 | 0.73 | ALDH1A1 (0.50) | NPC1HPGDRAB9ASMN1; SMN2SIGMAR1 | |
| SCHEMBL29687292 | 0.73 | ALDH1A1 (0.50) | NPC1HPGDRAB9ASMN1; SMN2SIGMAR1 | |
| SCHEMBL2424631 | 0.72 | NPC1 (0.96) | NPC1HPGDRAB9ASMN1; SMN2TRPA1 |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109476641-A | Heterocyclic inhibitors of CBP/EP300 and their use in the treatment of cancer | 基因泰克公司 | 2019-03-15 | — | — | CN | disclosed |
| US-10174011-B2 | Heterocyclic compounds, process for preparation of the same and use thereof | SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) | 2019-01-08 | — | — | US | disclosed |
| CN-106083899-B | Condensed heterocyclic derivates and application method | 安姆根有限公司 | 2018-11-09 | — | — | CN | disclosed |
| CN-108069959-A | A kind of nitrogen-containing hetero cyclics, its preparation method, pharmaceutical composition and application | 凯惠科技发展(上海)有限公司 | 2018-05-25 | — | — | CN | disclosed |
| US-20170158680-A1 | HETEROCYCLIC COMPOUNDS, PROCESS FOR PREPARATION OF THE SAME AND USE THEREOF | SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) | 2017-06-08 | — | — | US | disclosed |
| US-9296782-B2 | Inhibitors of hepatitis C virus | GILEAD SCIENCES, INC. (US) | 2016-03-29 | — | — | US | disclosed |
| WO-2015020112-A1 | DIFLUOROMETHYLENE COMPOUND | 石原産業株式会社 (JP) | 2015-02-12 | — | — | WO | disclosed |
| US-8853443-B2 | Process for preparing an isocyanate | BASF SE (DE) | 2014-10-07 | — | — | US | disclosed |
| US-20140017198-A1 | INHIBITORS OF HEPATITIS C VIRUS | GILEAD PHARMASSET LLC | 2014-01-16 | — | — | US | disclosed |
| CN-103298816-A | Substituted pyrazolo-quinazoline derivatives as kinase inhibitors | NERVIANO MEDICAL SCIENCES SRL | 2013-09-11 | — | — | CN | disclosed |
| CN-102850336-A | DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZ0 [B] THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS | OTSUKA PHARMA CO LTD | 2013-01-02 | — | — | CN | disclosed |
| WO-2011143444-A2 | DIPHENYLBUTYPIPERIDINE AUTOPHAGY INDUCERS | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2011-11-17 | — | — | WO | disclosed |
| US-20110263892-A1 | PROCESS FOR PREPARING AN ISOCYANATE | BASF SE (DE) | 2011-10-27 | — | — | US | disclosed |
| CN-101563351-A | Substituted pyrazolo-quinazoline derivatives, process for their preparation and their use as kinase inhibitors | NERVIANO MEDICAL SCIENCES SRL (IT) | 2009-10-21 | — | — | CN | disclosed |
| US-20080171755-A1 | Pyrimidinylpyrazoles as Tgf-Beta Inhibitors | LEE WEN-CHERNG | 2008-07-17 | — | — | 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 (5 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-20110263892-A1 | PROCESS FOR PREPARING AN ISOCYANATE | IDH1, IDH2, GMNN | NPC1 3131/4885HPGD 15/4885RAB9A 2291/4885 |
| US-10174011-B2 | Heterocyclic compounds, process for preparation of the same and use thereof | CYP11B2, CYP11B1, ADCYAP1R1 | NPC1 64/4885HPGD 93/4885RAB9A 1489/4885 |
| US-20080171755-A1 | Pyrimidinylpyrazoles as Tgf-Beta Inhibitors | TGFBR1, SMAD3, ALK | NPC1 2751/4885HPGD 3075/4885RAB9A 4130/4885 |
| US-20140017198-A1 | INHIBITORS OF HEPATITIS C VIRUS | HAVCR2, SLC10A1, GOT1 | NPC1 20/4885HPGD 623/4885RAB9A 1219/4885 |
| US-20170158680-A1 | HETEROCYCLIC COMPOUNDS, PROCESS FOR PREPARATION OF THE SAME AND USE THEREOF | CYP11B2, CYP11B1, ADCYAP1R1 | NPC1 64/4885HPGD 93/4885RAB9A 1489/4885 |
“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.