SCHEMBL20007452

SCHEMBL20007452

N#Cc1ccc(S(=O)(=O)N2CC(Oc3cc(F)c(C#N)cc3OCC(F)(F)F)[C@](O)(CO)C2)cc1

nearest known ligand 0.64

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 20/20 0.64

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
SCHEMBL19995308 1.00 TRPV4 (0.64) TRPV4
SCHEMBL21144197 0.94 TRPV4 (0.64) TRPV4
SCHEMBL19995340 0.91 TRPV4 (0.77) TRPV4
SCHEMBL20007718 0.91 TRPV4 (0.77) TRPV4
SCHEMBL23613894 0.90 TRPV4 (0.70) TRPV4
SCHEMBL21171945 0.90 TRPV4 (0.70) TRPV4
SCHEMBL29354006 0.90 TRPV4 (0.70) TRPV4
SCHEMBL20007286 0.89 TRPV4 (0.57) TRPV4
SCHEMBL21144474 0.88 TRPV4 (0.59) TRPV4
SCHEMBL20007803 0.88 TRPV4 (0.59) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3515887-B1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2021-07-07 EP disclosed
WO-2018055524-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2018-03-29 WO disclosed