SCHEMBL7228587

SCHEMBL7228587

CCCC=Cc1ccc(CCc2cc(F)c(CCC)c(F)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TNNC1 P63316 1/20 0.39
GPR183 P32249 1/20 0.33
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MITF O75030 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
KLF5 Q13887 1/20 0.31
NPC1 O15118 1/20 0.30
TP53 P04637 1/20 0.30
PKM P14618 1/20 0.30
RAB9A P51151 1/20 0.30
HSD17B10 Q99714 1/20 0.30
GPR84 Q9NQS5 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
SCHEMBL7228583 1.00 TNNC1 (0.39) TNNC1GPR183CYP4F2CYP4A11PTGS1
SCHEMBL7233371 0.94 TNNC1 (0.40) TNNC1GPR183PTGS1PTGS2SMN1; SMN2
SCHEMBL7233365 0.94 TNNC1 (0.40) TNNC1GPR183PTGS1PTGS2SMN1; SMN2
SCHEMBL7228490 0.92 TNNC1 (0.45) TNNC1GPR183
SCHEMBL7228488 0.92 TNNC1 (0.45) TNNC1GPR183
SCHEMBL7236854 0.92 TNNC1 (0.42) TNNC1PTGS1PTGS2HPGDNPC1
SCHEMBL7236859 0.92 TNNC1 (0.42) TNNC1PTGS1PTGS2HPGDNPC1
SCHEMBL7239630 0.91 TNNC1 (0.39) TNNC1GPR183CYP4F2CYP4A11PTGS1
SCHEMBL7239632 0.91 TNNC1 (0.39) TNNC1GPR183CYP4F2CYP4A11PTGS1
SCHEMBL7232455 0.90 TNNC1 (0.50) TNNC1

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