SCHEMBL20007287

SCHEMBL20007287

N#Cc1cc(Cl)ccc1S(=O)(=O)N1CCC(CO)C1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 19/20 0.55
ACLY P53396 1/20 0.43

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
SCHEMBL20007694 0.86 CYP3A4 (0.53) TRPV4
SCHEMBL20003532 0.84 ACLY (0.53) TRPV4ACLY
SCHEMBL20003506 0.81 CYP19A1 (0.60) TRPV4
SCHEMBL29355694 0.75 TRPV4 (0.51) TRPV4
SCHEMBL21144246 0.75 TRPV4 (0.51) TRPV4
SCHEMBL21144245 0.75 TRPV4 (0.51) TRPV4
SCHEMBL20003557 0.74 TRPV4 (0.59) TRPV4
SCHEMBL14034045 0.71 CNR1 (0.55) ACLY
SCHEMBL20007281 0.71 TRPV4 (0.52) TRPV4
SCHEMBL20003613 0.71 TRPV4 (0.55) TRPV4

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
WO-2018055524-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2018-03-29 WO disclosed