SCHEMBL7239356

SCHEMBL7239356

CCC/C=C/c1cc(F)c(CCc2ccc(F)c(F)c2)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 2/20 0.35
DAO P14920 2/20 0.35
TRPV3 Q8NET8 1/20 0.32
TRPA1 O75762 1/20 0.31
TNNC1 P63316 1/20 0.30
RIPK1 Q13546 1/20 0.30
CYP51A1 Q16850 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
SCHEMBL7239358 1.00 NFE2L2 (0.35) NFE2L2DAOTRPV3TRPA1TNNC1
SCHEMBL7230695 0.87
SCHEMBL7230698 0.87
SCHEMBL7236444 0.87 NFE2L2 (0.41) NFE2L2DAOTRPA1TNNC1RIPK1
SCHEMBL7236446 0.87 NFE2L2 (0.41) NFE2L2DAOTRPA1TNNC1RIPK1
SCHEMBL7228749 0.85 TUBB1 (0.33) TRPA1
SCHEMBL7228753 0.85 TUBB1 (0.33) TRPA1
SCHEMBL7228595 0.84 DAO (0.41) DAO
SCHEMBL7228593 0.84 DAO (0.41) DAO
SCHEMBL7237574 0.83 NFE2L2 (0.40) NFE2L2DAOTRPV3TRPA1TNNC1

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 6 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
EP-0781827-B1 Liquid crystal mixture and liquid crystal device comprising the same SUMITOMO CHEMICAL CO (JP) 2001-06-13 EP 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