SCHEMBL8618571

SCHEMBL8618571

CCC/C=C/c1ccc(C#Cc2cc(F)c(C#N)c(F)c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 1/20 0.33
P4HB P07237 2/20 0.32
FFAR1 O14842 1/20 0.31

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
SCHEMBL8618576 1.00 TRPV4 (0.33) TRPV4P4HBFFAR1
SCHEMBL8621471 0.86 FFAR1 (0.34) FFAR1
SCHEMBL8621475 0.86 FFAR1 (0.34) FFAR1
SCHEMBL8616904 0.85 TRPV4 (0.36) TRPV4P4HBFFAR1
SCHEMBL8616906 0.85 TRPV4 (0.36) TRPV4P4HBFFAR1
SCHEMBL8617838 0.83 NFE2L2 (0.40) FFAR1
SCHEMBL8617834 0.83 NFE2L2 (0.40) FFAR1
SCHEMBL8623117 0.82 CYP2A6 (0.41) P4HBFFAR1
SCHEMBL8623114 0.82 CYP2A6 (0.41) P4HBFFAR1
SCHEMBL7229941 0.81 TRPV4 (0.37) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0648723-B1 Diphenylacetylene compound, process for preparing the same and liquid crystal composition and element comprising the same SUMITOMO CHEMICAL CO (JP) 1998-05-20 EP disclosed
US-5658489-A EXCELLENT ANISOTROPY OF REFRACTIVE INDEX; LOW VISCOSITY SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-08-19 US disclosed
EP-0648723-A1 Diphenylacetylene compound, process for preparing the same and liquid crystal composition and element comprising the same SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-04-19 EP disclosed