SCHEMBL7501757

SCHEMBL7501757

CCCCc1nc(Sc2ccc(OC)cc2)c(C(=O)O)n1Cc1cc2c(cc1Cl)OCO2

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 4/20 0.55
EDNRB P24530 3/20 0.38
BRS3 P32247 1/20 0.38

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
SCHEMBL8434768 0.92 EDNRA (0.52) EDNRAEDNRBBRS3
SCHEMBL7496916 0.89 EDNRA (0.54) EDNRAEDNRBBRS3
SCHEMBL7506638 0.89 EDNRA (0.45) EDNRAEDNRBBRS3
SCHEMBL7499877 0.88 EDNRA (0.45) EDNRAEDNRBBRS3
SCHEMBL7495951 0.86 EDNRA (0.46) EDNRAEDNRBBRS3
SCHEMBL6579920 0.86 EDNRA (0.46) EDNRAEDNRBBRS3
SCHEMBL6162876 0.86 EDNRA (0.60) EDNRAEDNRB
SCHEMBL6159406 0.85 EDNRA (0.63) EDNRA
SCHEMBL7498870 0.85 EDNRA (0.59) EDNRAEDNRB
SCHEMBL7494883 0.85 EDNRA (0.46) EDNRAEDNRBBRS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0776325-B1 NOVEL USE AND NOVEL DERIVATIVES OF IMIDAZOLE, METHOD FOR PREPARING SAME, NOVEL INTERMEDIATES THUS OBTAINED, MEDICINAL APPLICATIONS OF SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME AVENTIS PHARMA SA (FR) 2002-11-20 EP claimed
US-5811444-A IMIDAZOLE DERIVATIVES ROUSSEL UCLAF (FR) 1998-09-22 US disclosed