SCHEMBL4971298

SCHEMBL4971298

Cc1cc(I)sc1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.44
RXFP1 Q9HBX9 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
GPR35 Q9HC97 5/20 0.43
DAO P14920 3/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
MCL1 Q07820 2/20 0.40
BCL2L1 Q07817 1/20 0.40
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
POLB P06746 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL14029320 0.83 KDM4E (0.38) PKMRXFP1NPSR1GPR35DAO
SCHEMBL13545971 0.78 MAPT (0.44) KDM4EALDH1A1MEN1MAPTKMT2A
SCHEMBL5104631 0.77 PKM (0.52) PKMRXFP1NPSR1GPR35DAO
SCHEMBL3093344 0.76 DAO (0.65) PKMRXFP1NPSR1GPR35DAO
SCHEMBL6427755 0.75 RXFP1 (0.38) PKMRXFP1NPSR1GPR35DAO
SCHEMBL20439913 0.74 DAO (0.42) PKMRXFP1NPSR1GPR35DAO
SCHEMBL243572 0.74 KDM4E (0.42) PKMRXFP1NPSR1GPR35DAO
SCHEMBL20894075 0.74 BCKDK (0.40) PKMRXFP1NPSR1GPR35DAO
SCHEMBL12917930 0.74 DAO (0.42) PKMRXFP1NPSR1GPR35DAO
SCHEMBL364130 0.74 GPR35 (0.44) PKMRXFP1NPSR1GPR35DAO

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008115912-A1 REGIO-SPECIFIC SYNTHESIS OF 4-BROMO-3-METHYL-5-PROPOXY-THIOPHENE-2-CARBOXYLIC ACID SANOFI-AVENTIS (FR) 2008-09-25 WO claimed
US-11760762-B2 Thienopyranones and furanopyranones as kinase, bromodomain, and checkpoint inhibitors SIGNALRX PHARMACEUTICALS, INC. (US) 2023-09-19 US disclosed
WO-2008121666-A1 USE OF 4-BROMO-3-METHYL-5-PROPOXYTHIOPHENE-2-CARBOXYLIC ACID 2,5-DIOXO-PYRROLIDIN-1-YL ESTER FOR PREPARING THE TRYPTASE INHIBITOR [4-(5-AMINOMETHYL-2-FLUORO-PHENYL)-PIPERIDIN-1-YL]-(4-BROMO-3-METHYL-5-PROPOXY-THIOPHEN-2-YL)-METHANONE SANOFI-AVENTIS (FR) 2008-10-09 WO disclosed
WO-2008115912-A1 REGIO-SPECIFIC SYNTHESIS OF 4-BROMO-3-METHYL-5-PROPOXY-THIOPHENE-2-CARBOXYLIC ACID SANOFI-AVENTIS (FR) 2008-09-25 WO disclosed
WO-2008115912-A1 REGIO-SPECIFIC SYNTHESIS OF 4-BROMO-3-METHYL-5-PROPOXY-THIOPHENE-2-CARBOXYLIC ACID SANOFI-AVENTIS (FR) 2008-09-25 WO disclosed
WO-2008115912-A1 REGIO-SPECIFIC SYNTHESIS OF 4-BROMO-3-METHYL-5-PROPOXY-THIOPHENE-2-CARBOXYLIC ACID SANOFI-AVENTIS (FR) 2008-09-25 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 (1 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-11760762-B2 Thienopyranones and furanopyranones as kinase, bromodomain, and checkpoint inhibitors CDK1, CDKN1A, CDKL1 PKM 1522/4885RXFP1 4203/4885NPSR1 3727/4885

“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.