SCHEMBL7735386

SCHEMBL7735386

C/C=C/CC1CCC(c2ccc(C(F)(F)Oc3ccc(C#N)c(F)c3)cc2)CC1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPC3 Q13507 1/20 0.36
TRPC6 Q9Y210 1/20 0.36
TRPV4 Q9HBA0 5/20 0.33
AOC3 Q16853 1/20 0.31
AR P10275 4/20 0.30
KDM1A O60341 1/20 0.30
FFAR1 O14842 1/20 0.30
FFAR4 Q5NUL3 1/20 0.30

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
SCHEMBL7735389 1.00 TRPC3 (0.36) TRPC3TRPC6TRPV4AOC3AR
SCHEMBL7735388 1.00 TRPC3 (0.36) TRPC3TRPC6TRPV4AOC3AR
SCHEMBL7735383 1.00 TRPC3 (0.36) TRPC3TRPC6TRPV4AOC3AR
SCHEMBL8475052 1.00 TRPC3 (0.36) TRPC3TRPC6TRPV4AOC3AR
SCHEMBL8470846 0.91 TRPC3 (0.34) TRPC3TRPC6TRPV4AOC3FFAR1
SCHEMBL7730421 0.91 TRPC3 (0.34) TRPC3TRPC6TRPV4AOC3FFAR1
SCHEMBL7735143 0.91 TRPV4 (0.34) TRPC3TRPC6TRPV4AOC3KDM1A
SCHEMBL7735136 0.91 TRPV4 (0.34) TRPC3TRPC6TRPV4AOC3KDM1A
SCHEMBL7730408 0.91 TRPC3 (0.34) TRPC3TRPC6TRPV4AOC3FFAR1
SCHEMBL7730417 0.91 TRPC3 (0.34) TRPC3TRPC6TRPV4AOC3FFAR1

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-0786445-B1 DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORP (JP) 2002-07-17 EP disclosed
EP-0786445-A1 DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1997-07-30 EP disclosed