SCHEMBL7239666

SCHEMBL7239666

CCC/C(F)=C(\F)c1ccc(C(=O)O)c(-c2ccc(CCC)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.47
RARB P10826 11/20 0.44
LTB4R2 Q9NPC1 2/20 0.43
RARA P10276 2/20 0.43
RARG P13631 1/20 0.43
MPL P40238 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
MTOR P42345 1/20 0.40
KMT2A Q03164 1/20 0.40
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PPARG P37231 1/20 0.39

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
SCHEMBL7239672 1.00 MCL1 (0.47) MCL1RARBLTB4R2RARARARG
SCHEMBL7240645 0.92 RARB (0.56) RARBRARARARGMEN1ALDH1A1
SCHEMBL7240642 0.92 RARB (0.56) RARBRARARARGMEN1ALDH1A1
SCHEMBL7233358 0.91 RARB (0.58) RARBRARARARGMEN1ALDH1A1
SCHEMBL7233351 0.91 RARB (0.58) RARBRARARARGMEN1ALDH1A1
SCHEMBL7232053 0.88 LTB4R2 (0.39) MCL1RARBLTB4R2L3MBTL1MEN1
SCHEMBL7232047 0.88 LTB4R2 (0.39) MCL1RARBLTB4R2L3MBTL1MEN1
SCHEMBL7239310 0.86 LTB4R2 (0.42) MCL1RARBLTB4R2RARARARG
SCHEMBL7239308 0.86 LTB4R2 (0.42) MCL1RARBLTB4R2RARARARG
SCHEMBL7238446 0.86 RARB (0.58) RARBRARARARGMEN1ALDH1A1

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