SCHEMBL7240288

SCHEMBL7240288

CCC/C=C(/F)c1ccc(-c2cc(CCC)ccc2C(=O)O)cc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.43
RARB P10826 9/20 0.41
LTB4R2 Q9NPC1 2/20 0.41
RARA P10276 1/20 0.40
RARG P13631 1/20 0.40
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PPARG P37231 3/20 0.38
METAP2 P50579 1/20 0.38
FOLH1 Q04609 1/20 0.38
PPARA Q07869 1/20 0.38

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
SCHEMBL7240291 1.00 MCL1 (0.43) MCL1RARBLTB4R2RARARARG
SCHEMBL7237869 0.86 RARB (0.51) RARBRARARARG
SCHEMBL7237865 0.86 RARB (0.51) RARBRARARARG
SCHEMBL7238838 0.85 HDAC7 (0.40) MCL1RARBLTB4R2
SCHEMBL7238839 0.85 HDAC7 (0.40) MCL1RARBLTB4R2
SCHEMBL7236328 0.81 MCL1 (0.45) MCL1RARBLTB4R2RARARARG
SCHEMBL7236334 0.81 MCL1 (0.45) MCL1RARBLTB4R2RARARARG
SCHEMBL7237325 0.80 RARB (0.57) RARBRARARARGPPARGPPARA
SCHEMBL7237323 0.80 RARB (0.57) RARBRARARARGPPARGPPARA
SCHEMBL7232495 0.78 MCL1 (0.45) MCL1RARBLTB4R2RARARARG

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