SCHEMBL7229661

SCHEMBL7229661

CCCCCCCCCCc1ccc(-c2ccc(C(F)=C(F)CCCCCCC)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 10/20 0.59
ALDH1A1 P00352 2/20 0.59
RARA P10276 2/20 0.59
MEN1 O00255 1/20 0.59
MAPT P10636 1/20 0.59
MTOR P42345 1/20 0.59
KMT2A Q03164 1/20 0.59
HSD17B10 Q99714 2/20 0.53
TSHR P16473 1/20 0.53
THRA P10827 1/20 0.52
THRB P10828 1/20 0.52
FAAH O00519 1/20 0.50
ESR1 P03372 2/20 0.49
ADRA2A P08913 2/20 0.49
ADORA3 P0DMS8 2/20 0.49
TACR2 P21452 2/20 0.49
SLC6A2 P23975 2/20 0.49
SLC6A4 P31645 2/20 0.49
SLC6A3 Q01959 2/20 0.49
KDM4E B2RXH2 1/20 0.49

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
SCHEMBL7229654 1.00 RARB (0.59) RARBALDH1A1RARAMEN1MAPT
SCHEMBL7766191 1.00 RARB (0.59) RARBALDH1A1RARAMEN1MAPT
SCHEMBL7766201 1.00 RARB (0.59) RARBALDH1A1RARAMEN1MAPT
SCHEMBL7766214 1.00 RARB (0.59) RARBALDH1A1RARAMEN1MAPT
SCHEMBL7229659 1.00 RARB (0.59) RARBALDH1A1RARAMEN1MAPT
SCHEMBL7241120 0.98 RARB (0.58) RARBALDH1A1RARAMEN1MAPT
SCHEMBL7241123 0.98 RARB (0.58) RARBALDH1A1RARAMEN1MAPT
SCHEMBL7241118 0.98 RARB (0.58) RARBALDH1A1RARAMEN1MAPT
SCHEMBL7238739 0.94 THRA (0.55) RARBALDH1A1RARAMEN1MAPT
SCHEMBL7238737 0.94 THRA (0.55) RARBALDH1A1RARAMEN1MAPT

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