SCHEMBL7230294

SCHEMBL7230294

CCCCCC(F)=C(F)c1ccc(Oc2ccc(CCC)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.40
THRA P10827 1/20 0.40
S1PR1 P21453 1/20 0.39
S1PR3 Q99500 1/20 0.39
LTA4H P09960 2/20 0.39
FAAH O00519 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ACACB O00763 1/20 0.38
ACACA Q13085 1/20 0.38
SRD5A2 P31213 1/20 0.38
RARB P10826 1/20 0.37
STAT3 P40763 1/20 0.37

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
SCHEMBL7230288 1.00 THRB (0.40) THRBTHRAS1PR1S1PR3LTA4H
SCHEMBL7230286 1.00 THRB (0.40) THRBTHRAS1PR1S1PR3LTA4H
SCHEMBL7231000 0.90 L3MBTL1 (0.41) THRBS1PR1S1PR3L3MBTL1ACACB
SCHEMBL7231007 0.90 L3MBTL1 (0.41) THRBS1PR1S1PR3L3MBTL1ACACB
SCHEMBL7231002 0.90 L3MBTL1 (0.41) THRBS1PR1S1PR3L3MBTL1ACACB
SCHEMBL7240937 0.89 THRB (0.47) THRBTHRAS1PR1S1PR3RARB
SCHEMBL7240931 0.89 THRB (0.47) THRBTHRAS1PR1S1PR3RARB
SCHEMBL7240928 0.89 THRB (0.47) THRBTHRAS1PR1S1PR3RARB
SCHEMBL7239867 0.88 THRA (0.48) THRBTHRAS1PR1S1PR3FAAH
SCHEMBL7239859 0.88 THRA (0.48) THRBTHRAS1PR1S1PR3FAAH

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