SCHEMBL7228488

SCHEMBL7228488

CCCC/C=C/c1ccc(CCc2cc(F)c(CCC)c(F)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TNNC1 P63316 1/20 0.45
SPHK1 Q9NYA1 2/20 0.33
RARB P10826 3/20 0.32
SPHK2 Q9NRA0 1/20 0.32
HTR2A P28223 1/20 0.32
GPR183 P32249 1/20 0.32
NAMPT P43490 1/20 0.32
RARA P10276 1/20 0.32
RARG P13631 1/20 0.32
CTNNB1 P35222 2/20 0.31
TCF7L2 Q9NQB0 2/20 0.31
PDE5A O76074 1/20 0.31
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31
GRIN3A Q8TCU5 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
SCHEMBL7228490 1.00 TNNC1 (0.45) TNNC1SPHK1RARBSPHK2HTR2A
SCHEMBL7232455 0.96 TNNC1 (0.50) TNNC1SPHK1RARBSPHK2HTR2A
SCHEMBL7232452 0.96 TNNC1 (0.50) TNNC1SPHK1RARBSPHK2HTR2A
SCHEMBL7228587 0.92 TNNC1 (0.39) TNNC1GPR183
SCHEMBL7228583 0.92 TNNC1 (0.39) TNNC1GPR183
SCHEMBL7236859 0.89 TNNC1 (0.42) TNNC1SPHK1RARBSPHK2HTR2A
SCHEMBL7233371 0.89 TNNC1 (0.40) TNNC1SPHK1RARBSPHK2HTR2A
SCHEMBL7236854 0.89 TNNC1 (0.42) TNNC1SPHK1RARBSPHK2HTR2A
SCHEMBL7233365 0.89 TNNC1 (0.40) TNNC1SPHK1RARBSPHK2HTR2A
SCHEMBL7231757 0.89 TNNC1 (0.47) TNNC1SPHK1RARBSPHK2HTR2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6623810-B2 Refractive index anisotropy SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-09-23 US disclosed
US-20010050353-A1 Phenylacetylene compound, liquid crystal composition, and liquid crystal element produced with the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-12-13 US disclosed
US-6149837-A SUBSTITUTED 1,4-BIS(SUBSTITUED PHENYLACETYLENE)BENZENE WHERE AT LEAST ONE RING HAS AN ALKYL ATTACHMENT, HAS A LARGE ANISOTROPY OF REFRACTIVE INDEX, TENDS TO BE MIXED WITH OTHER LIQUID CRYSTALS, IS LIGHT STABLE; LIQUID CRYSTAL ELEMENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-11-21 US disclosed
US-5866035-A LARGE BIREFRINGENCE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-02-02 US disclosed
EP-0781827-A1 Liquid crystal mixture and liquid crystal device comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-02 EP disclosed