SCHEMBL7507367

SCHEMBL7507367

CCCc1nc(Sc2ccc(OC)c(OC)c2)c(OC(=O)O)n1Cc1cc2c(cc1Cl)OCO2

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 11/20 0.48
EDNRB P24530 10/20 0.42
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 3/20 0.34
TP53 P04637 1/20 0.34
THRB P10828 1/20 0.34
MAPT P10636 1/20 0.33

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
SCHEMBL7498870 0.89 EDNRA (0.59) EDNRAEDNRBKDM4EALDH1A1HPGD
SCHEMBL6159408 0.88 EDNRA (0.52) EDNRAKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL7506638 0.86 EDNRA (0.45) EDNRAEDNRBKDM4EALDH1A1HPGD
SCHEMBL6580607 0.85 EDNRA (0.42) EDNRAEDNRBKDM4EALDH1A1HPGD
SCHEMBL6162886 0.85 EDNRA (0.49) EDNRAEDNRBKDM4EALDH1A1HPGD
SCHEMBL8434241 0.80 EDNRA (0.53) EDNRAEDNRBKDM4EALDH1A1HPGD
SCHEMBL6579951 0.79 SMN1; SMN2 (0.41) EDNRAKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL7503953 0.79 EDNRA (0.53) EDNRAKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL8434286 0.78 EDNRA (0.64) EDNRAEDNRBKDM4EALDH1A1HPGD
SCHEMBL8431316 0.78 EDNRA (0.52) EDNRAEDNRBKDM4EALDH1A1HPGD

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-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