SCHEMBL20003557

SCHEMBL20003557

N#Cc1cc(Cl)ccc1S(=O)(=O)N1CC[C@](O)(CO)C1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 20/20 0.59
TRPM8 Q7Z2W7 2/20 0.53
KCNH2 Q12809 1/20 0.49

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
SCHEMBL20003616 0.84 TRPV4 (0.60) TRPV4TRPM8KCNH2
SCHEMBL23613871 0.84 TRPV4 (0.60) TRPV4TRPM8KCNH2
SCHEMBL20003518 0.84 TRPV4 (0.60) TRPV4TRPM8KCNH2
SCHEMBL23613832 0.84 TRPV4 (0.57) TRPV4
SCHEMBL20007296 0.84 TRPV4 (0.57) TRPV4
SCHEMBL20007697 0.83 TRPV4 (0.52) TRPV4
SCHEMBL20003513 0.82 TRPV4 (0.61) TRPV4TRPM8
SCHEMBL20003510 0.82 TRPV4 (0.61) TRPV4TRPM8
SCHEMBL20007658 0.80 TRPV4 (0.50) TRPV4TRPM8KCNH2
SCHEMBL23176162 0.80 PKM (0.54) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3515888-B1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2021-03-31 EP disclosed
WO-2018055526-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2018-03-29 WO disclosed
WO-2018055524-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2018-03-29 WO disclosed