SCHEMBL7240642

SCHEMBL7240642

CCCCCc1ccc(-c2cc(/C(F)=C(\F)CCC)ccc2C(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RARB P10826 11/20 0.56
RARA P10276 2/20 0.55
RARG P13631 1/20 0.55
MEN1 O00255 1/20 0.52
ALDH1A1 P00352 1/20 0.52
MAPT P10636 1/20 0.52
MTOR P42345 1/20 0.52
KMT2A Q03164 1/20 0.52
PPARA Q07869 2/20 0.47
PLK1 P53350 3/20 0.46
PLK3 Q9H4B4 1/20 0.46
PPARG P37231 1/20 0.44
KAT8 Q9H7Z6 2/20 0.44

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
SCHEMBL7240645 1.00 RARB (0.56) RARBRARARARGMEN1ALDH1A1
SCHEMBL7233351 0.99 RARB (0.58) RARBRARARARGMEN1ALDH1A1
SCHEMBL7233358 0.99 RARB (0.58) RARBRARARARGMEN1ALDH1A1
SCHEMBL7239020 0.94 RARB (0.58) RARBRARARARGMEN1ALDH1A1
SCHEMBL7239018 0.94 RARB (0.58) RARBRARARARGMEN1ALDH1A1
SCHEMBL7238446 0.94 RARB (0.58) RARBRARARARGMEN1ALDH1A1
SCHEMBL7238443 0.94 RARB (0.58) RARBRARARARGMEN1ALDH1A1
SCHEMBL7239666 0.92 MCL1 (0.47) RARBRARARARGMEN1ALDH1A1
SCHEMBL7239672 0.92 MCL1 (0.47) RARBRARARARGMEN1ALDH1A1
SCHEMBL7232053 0.84 LTB4R2 (0.39) RARBMEN1ALDH1A1KMT2APLK1

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
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
EP-0781827-A1 Liquid crystal mixture and liquid crystal device comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-02 EP disclosed