SCHEMBL600887

SCHEMBL600887

CC(=O)c1ncc(C(=O)O)s1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.61
ALDH1A1 P00352 4/20 0.42
DAO P14920 4/20 0.39
KDM4E B2RXH2 2/20 0.38
GAA P10253 1/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
CCNE1 P24864 1/20 0.37
CDK2 P24941 1/20 0.37
CDK5 Q00535 1/20 0.37
RXRA P19793 3/20 0.37
RXRB P28702 3/20 0.37
RXRG P48443 3/20 0.37
RARB P10826 2/20 0.37
RARG P13631 2/20 0.37
RARA P10276 1/20 0.37
USP7 Q93009 1/20 0.37

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL1810308 0.84 HCAR2 (0.61) HCAR2ALDH1A1DAOKDM4EGAA
SCHEMBL24036436 0.83 HCAR2 (0.57) HCAR2ALDH1A1DAOKDM4EGAA
SCHEMBL17204603 0.83 HCAR2 (0.50) HCAR2ALDH1A1DAOKDM4EGAA
Hydrochloric Acid SCHEMBL11597191 0.82 HCAR2 (0.59) HCAR2ALDH1A1DAOKDM4EGAA
SCHEMBL21836283 0.82 ALDH1A1 (0.42) HCAR2ALDH1A1KDM4EGAARAB9A
SCHEMBL4019091 0.78 HCAR2 (0.55) HCAR2ALDH1A1DAOKDM4EGAA
SCHEMBL324369 0.77
SCHEMBL186167 0.76
Hydrochloric Acid SCHEMBL29229113 0.76 HCAR2 (0.57) HCAR2ALDH1A1DAOKDM4EGAA
SCHEMBL1357514 0.75 ALDH1A1 (0.46) HCAR2ALDH1A1KDM4ERAB9ASMN1; SMN2

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 85 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117567388-B Synthesis method of 2-acetyl-5-thiazole formic acid 济南悟通生物科技有限公司 2024-04-16 CN claimed
CN-117567388-A Synthesis method of 2-acetyl-5-thiazole formic acid 济南悟通生物科技有限公司 2024-02-20 CN claimed
US-12129249-B2 Method for producing optically active compound DAY ONE BIOPHARMACEUTICALS, INC. (US) 2024-10-29 US disclosed
EP-4406609-A2 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND Day One Biopharmaceuticals, Inc. (US) 2024-07-31 EP disclosed
EP-3632441-B1 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND DAY ONE BIOPHARMACEUTICALS INC (US) 2024-07-17 EP disclosed
EP-3632441-B1 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND DAY ONE BIOPHARMACEUTICALS INC (US) 2024-07-17 EP disclosed
CN-117567388-B Synthesis method of 2-acetyl-5-thiazole formic acid 济南悟通生物科技有限公司 2024-04-16 CN disclosed
CN-117567388-B Synthesis method of 2-acetyl-5-thiazole formic acid 济南悟通生物科技有限公司 2024-04-16 CN disclosed
CN-117567388-B Synthesis method of 2-acetyl-5-thiazole formic acid 济南悟通生物科技有限公司 2024-04-16 CN disclosed
CN-117567388-A Synthesis method of 2-acetyl-5-thiazole formic acid 济南悟通生物科技有限公司 2024-02-20 CN disclosed
CN-117567388-A Synthesis method of 2-acetyl-5-thiazole formic acid 济南悟通生物科技有限公司 2024-02-20 CN disclosed
US-20090036419-A1 COMPOUNDS USEFUL AS RAF KINASE INHIBITORS SUNESIS PHARMACEUTICALS, INC. (US) 2009-02-05 US disclosed
US-20090036419-A1 COMPOUNDS USEFUL AS RAF KINASE INHIBITORS SUNESIS PHARMACEUTICALS, INC. (US) 2009-02-05 US disclosed
WO-2009006404-A2 HETEROCYCLIC COMPOUNDS USEFUL AS RAF KINASE INHIBITORS SUNESIS PHARMACEUTICALS, INC. (US) 2009-01-08 WO disclosed
WO-2009006404-A2 HETEROCYCLIC COMPOUNDS USEFUL AS RAF KINASE INHIBITORS SUNESIS PHARMACEUTICALS, INC. (US) 2009-01-08 WO disclosed
WO-2009006389-A2 PYRIMIDINE DERIVATIVES USEFUL AS RAF KINASE INHIBITORS SUNESIS PHARMACEUTICALS, INC. (US) 2009-01-08 WO disclosed
WO-2009006389-A2 PYRIMIDINE DERIVATIVES USEFUL AS RAF KINASE INHIBITORS SUNESIS PHARMACEUTICALS, INC. (US) 2009-01-08 WO disclosed
US-20090005359-A1 Heterocyclic Compounds Useful as RAF Kinase Inhibitors SUNESIS PHARMACEUTICALS, INC (US) 2009-01-01 US disclosed
US-20090005359-A1 Heterocyclic Compounds Useful as RAF Kinase Inhibitors SUNESIS PHARMACEUTICALS, INC (US) 2009-01-01 US disclosed
US-20090005359-A1 Heterocyclic Compounds Useful as RAF Kinase Inhibitors SUNESIS PHARMACEUTICALS, INC (US) 2009-01-01 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 (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.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090036419-A1 COMPOUNDS USEFUL AS RAF KINASE INHIBITORS BRAF, RAF1, ARAF HCAR2 4010/4885ALDH1A1 2691/4885DAO 3162/4885
US-12129249-B2 Method for producing optically active compound DHPS, QDPR, SPR HCAR2 3810/4885ALDH1A1 1036/4885DAO 306/4885
US-20090005359-A1 Heterocyclic Compounds Useful as RAF Kinase Inhibitors BRAF, RAF1, ARAF HCAR2 2921/4885ALDH1A1 2165/4885DAO 2976/4885

“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.