SCHEMBL8784161

SCHEMBL8784161

CCCCc1ncc(Sc2ccc(OC)cc2)n1Cc1cc2c(cc1Cl)OCO2

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BRS3 P32247 3/20 0.39
EDNRA P25101 1/20 0.35

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
SCHEMBL8784160 0.82 BRS3 (0.42) BRS3
SCHEMBL7499877 0.80 EDNRA (0.45) BRS3EDNRA
SCHEMBL7501757 0.79 EDNRA (0.55) BRS3EDNRA
SCHEMBL8433794 0.78 EDNRA (0.40) BRS3EDNRA
SCHEMBL7506638 0.78 EDNRA (0.45) BRS3EDNRA
SCHEMBL8431316 0.73 EDNRA (0.52) BRS3EDNRA
SCHEMBL8431751 0.73 EDNRA (0.48) BRS3EDNRA
SCHEMBL8431746 0.72 EDNRA (0.48) BRS3EDNRA
SCHEMBL7496916 0.72 EDNRA (0.54) BRS3EDNRA
SCHEMBL8434768 0.71 EDNRA (0.52) BRS3EDNRA

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-A1 NOVEL USE AND NOVEL DERIVATIVES OF IMIDAZOLE, METHOD FOR PREPARING SAME, NOVEL INTERMEDIATES THUS OBTAINED, MEDICINAL APPLICATIONS OF SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME ROUSSEL UCLAF (FR) 1997-06-04 EP disclosed