SCHEMBL6580198

SCHEMBL6580198

COc1ccc(Sc2nc(Sc3ccccc3)n(Cc3cc4c(cc3Cl)OCO4)c2C(=O)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 10/20 0.44
EDNRB P24530 9/20 0.43
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL6579920 0.97 EDNRA (0.46) EDNRAEDNRBKDM4EALDH1A1HPGD
SCHEMBL6580278 0.92 EDNRA (0.45) EDNRAEDNRBKDM4EALDH1A1HPGD
SCHEMBL8524654 0.90 SMN1; SMN2 (0.39) EDNRAKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL7494883 0.89 EDNRA (0.46) EDNRAEDNRBKDM4EALDH1A1HPGD
SCHEMBL6582508 0.89 EDNRA (0.43) EDNRAEDNRBALDH1A1
SCHEMBL6582681 0.89 KDM4E (0.40) EDNRAEDNRBKDM4EALDH1A1HPGD
SCHEMBL7495951 0.89 EDNRA (0.46) EDNRAEDNRBKDM4EALDH1A1HPGD
SCHEMBL6582430 0.88 EDNRA (0.43) EDNRAEDNRBALDH1A1SMN1; SMN2
SCHEMBL8434768 0.87 EDNRA (0.52) EDNRAEDNRBKDM4EALDH1A1HPGD
SCHEMBL8432517 0.87 EDNRA (0.42) EDNRAEDNRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0804435-B1 NOVEL IMIDAZOLE DERIVATIVES, METHOD FOR PREPARING SAME, NOVEL INTERMEDIATES THUS OBTAINED, MEDICINAL APPLICATIONS OF SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME AVENTIS PHARMA SA (FR) 2004-03-10 EP claimed