SCHEMBL8568208

SCHEMBL8568208

CN(CNS(=O)(=O)c1ccccc1-c1ccc(-c2ncco2)cc1)CC(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 19/20 0.55
EDNRB P24530 18/20 0.55

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
SCHEMBL8566286 0.78 EDNRA (0.58) EDNRAEDNRB
SCHEMBL8720322 0.74 EDNRA (0.53) EDNRAEDNRB
SCHEMBL6640013 0.71 EDNRB (1.00) EDNRAEDNRB
SCHEMBL6986037 0.71 EDNRB (0.56) EDNRAEDNRB
SCHEMBL7868303 0.71 EDNRB (0.56) EDNRAEDNRB
SCHEMBL8566909 0.70 EDNRA (0.57) EDNRAEDNRB
SCHEMBL7508467 0.69 EDNRB (0.50) EDNRAEDNRB
SCHEMBL4204130 0.69 EDNRB (1.00) EDNRAEDNRB
SCHEMBL7506365 0.67 EDNRA (0.45) EDNRAEDNRB
SCHEMBL8568213 0.67 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
US-5846990-A Substituted biphenyl isoxazole sulfonamides BRISTOL-MYERS SQUIBB CO. (US) 1998-12-08 US disclosed