SCHEMBL7230865

SCHEMBL7230865

CCCc1ccc(CCc2ccc(C(F)=C(C)F)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.50
PLK1 P53350 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.44
LPL P06858 1/20 0.44
LIPG Q9Y5X9 1/20 0.44
ALDH1A1 P00352 3/20 0.42
GAA P10253 3/20 0.42
POLB P06746 2/20 0.42
CTDSP1 Q9GZU7 2/20 0.42
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
THRA P10827 2/20 0.40
TNNC1 P63316 5/20 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
SCHEMBL7230860 1.00 THRB (0.50) THRBPLK1L3MBTL1LPLLIPG
SCHEMBL7230853 1.00 THRB (0.50) THRBPLK1L3MBTL1LPLLIPG
SCHEMBL7233329 0.92 THRB (0.47) THRBPLK1L3MBTL1LPLLIPG
SCHEMBL7233321 0.92 THRB (0.47) THRBPLK1L3MBTL1LPLLIPG
SCHEMBL7233325 0.92 THRB (0.47) THRBPLK1L3MBTL1LPLLIPG
SCHEMBL7238740 0.88 THRB (0.45) THRBPLK1L3MBTL1LPLLIPG
SCHEMBL7238748 0.88 THRB (0.45) THRBPLK1L3MBTL1LPLLIPG
SCHEMBL7238744 0.88 THRB (0.45) THRBPLK1L3MBTL1LPLLIPG
SCHEMBL9022670 0.87 PLK1 (0.53) THRBPLK1L3MBTL1LPLLIPG
SCHEMBL8448673 0.87 PLK1 (0.53) THRBPLK1L3MBTL1LPLLIPG

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