SCHEMBL20007774

SCHEMBL20007774

N#Cc1ncccc1S(=O)(=O)N1CC[C@](O)(CO)C1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 12/20 0.55
TRPM8 Q7Z2W7 1/20 0.39
FABP1 P07148 1/20 0.39
RBP1 P09455 1/20 0.38
POLB P06746 1/20 0.36
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GRM1 Q13255 1/20 0.34
NR3C1 P04150 1/20 0.34

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
SCHEMBL20007697 0.81 TRPV4 (0.52) TRPV4RBP1KDM4EALDH1A1NR3C1
SCHEMBL23613943 0.78 TRPV4 (0.44) TRPV4FABP1POLBKDM4EALDH1A1
SCHEMBL20007281 0.74 TRPV4 (0.52) TRPV4FABP1ALOX5APFEN1ALDH1A1
SCHEMBL20007271 0.74 TRPV4 (0.43) TRPV4TRPM8RBP1
SCHEMBL20007310 0.74 TRPV4 (0.49) TRPV4TRPM8
SCHEMBL23613847 0.74 TRPV4 (0.57) TRPV4TRPM8KDM4E
SCHEMBL23614016 0.73 TRPV4 (0.55) TRPV4TRPM8
SCHEMBL23176371 0.73 TRPV4 (0.55) TRPV4TRPM8
SCHEMBL20003515 0.73 TRPV4 (0.52) TRPV4TRPM8RBP1
SCHEMBL20003513 0.73 TRPV4 (0.61) TRPV4TRPM8

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