Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | S100A4 | P26447 | 1/20 | 0.47 |
| ▸ | MTOR | P42345 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL17429321 | 0.79 | MEN1 (0.43) | ALDH1A1MEN1KMT2ACA1CA2 | |
| SCHEMBL9341811 | 0.79 | GAA (0.48) | GAAALDH1A1MAPTTDP1CYP1A2 | |
| SCHEMBL17429314 | 0.78 | HTR6 (0.44) | ALDH1A1MAPTTDP1KMT2AHPGD | |
| Water SCHEMBL3352692 | 0.78 | GAA (0.56) | GAAALDH1A1MAPTTDP1CYP1A2 | |
| SCHEMBL5332415 | 0.78 | GAA (0.46) | GAAALDH1A1MAPTTDP1CYP1A2 | |
| Acetonitrile SCHEMBL28199329 | 0.78 | GAA (0.46) | GAAALDH1A1MAPTTDP1CYP1A2 | |
| SCHEMBL17429307 | 0.76 | KIF11 (0.47) | MAPTKMT2ACA1CA2CA12 | |
| SCHEMBL27331250 | 0.76 | PARL (0.49) | GAAALDH1A1CA1CA2CA12 | |
| Water SCHEMBL8799285 | 0.76 | GAA (0.54) | GAAALDH1A1MAPTTDP1CYP1A2 | |
| SCHEMBL8482569 | 0.76 | GAA (0.54) | GAAALDH1A1MAPTTDP1CYP1A2 |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3990924-A1 | DETECTION OF PATHOGENIC BACTERIA BY CHEMICALLY FUNCTIONALIZED CELLULOSE | Centre national de la recherche scientifique (FR) | 2022-05-04 | — | — | EP | disclosed |
| WO-2021233783-A1 | PROCESS OF PREPARING BUTYL-(5S)-5-({2-[4-(BUTOXYCARBONYL)PHENYL]ETHYL}[2-(2-{[3-CHLORO-4'-(TRIFLUOROMETHYL)[BIPHENYL]-4-YL]METHOXY}PHENYL)ETHYL]AMINO)-5,6,7,8-TETRAHYDROQUINOLINE-2-CARBOXYLATE | BAYER AKTIENGESELLSCHAFT (DE) | 2021-11-25 | — | — | WO | disclosed |
| US-20210300921-A1 | EP4 INHIBITORS AND SYNTHESIS THEREOF | ASKAT INC. (JP) | 2021-09-30 | — | — | US | disclosed |
| US-9947965-B2 | Nonaqueous electrolyte solution and nonaqueous electrolyte battery using same | MITSUBISHI CHEMICAL CORPORATION (JP) | 2018-04-17 | — | — | US | disclosed |
| US-20160013517-A1 | NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY USING SAME | MITSUBISHI CHEMICAL CORPORATION (JP) | 2016-01-14 | — | — | US | disclosed |
| US-9217222-B2 | Prevention of body odour | HENKEL AG & CO. KGAA (DE) | 2015-12-22 | — | — | US | disclosed |
| US-20150364794-A1 | NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY USING SAME | MITSUBISHI CHEMICAL CORPORATION (JP) | 2015-12-17 | — | — | US | disclosed |
| CN-102124064-B | Composition for forming silicon-containing resist underlayer film with onium group | NISSAN CHEMICAL IND LTD | 2014-09-03 | — | — | CN | disclosed |
| CN-101296907-B | Diaminopyrimidines as P2X3 and P2X2/3 modulators | HOFFMANN LA ROCHE | 2013-03-27 | — | — | CN | disclosed |
| US-20120164097-A1 | PREVENTION OF BODY ODOUR | HENKEL AG & CO. KGAA (DE) | 2012-06-28 | — | — | US | disclosed |
| CN-102124064-A | Composition for forming silicon-containing resist underlayer film with onium group | NISSAN CHEMICAL IND LTD | 2011-07-13 | — | — | CN | disclosed |
| CN-101296907-A | Diaminopyrimidines as P2X3 and P2X2/3 modulators | ROCHE PALO ALTO LLC (CH) | 2008-10-29 | — | — | CN | disclosed |
| US-20070275954-A1 | Novel Fused Heterocycles and Uses Thereof | ASTRAZENECA AB (SE) | 2007-11-29 | — | — | US | disclosed |
| CN-1956971-A | Novel fused heterocycles and application thereof | ASTRAZENECA AB (SE) | 2007-05-02 | — | — | CN | disclosed |
| EP-1751119-A1 | NOVEL FUSED HETEROCYCLES AND USES THEREOF | AstraZeneca AB (SE) | 2007-02-14 | — | — | EP | disclosed |
| WO-2005111001-A1 | NOVEL FUSED HETEROCYCLES AND USES THEREOF | ASTRAZENECA AB (SE) | 2005-11-24 | — | — | WO | 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 (3 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-20210300921-A1 | EP4 INHIBITORS AND SYNTHESIS THEREOF | PTGER4, EPB41, CDK4 | GAA 4866/4885ALDH1A1 2142/4885MAPT 4594/4885 |
| US-20120164097-A1 | PREVENTION OF BODY ODOUR | CUTA, NOTUM, SLC14A1 | GAA 2904/4885ALDH1A1 642/4885MAPT 440/4885 |
| US-20070275954-A1 | Novel Fused Heterocycles and Uses Thereof | VIP, CCKBR, HRH2 | GAA 1097/4885ALDH1A1 836/4885MAPT 4771/4885 |
“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.