SCHEMBL7228630

SCHEMBL7228630

CCC=Cc1ccc(CCc2ccc(CCC)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNNC1 P63316 1/20 0.41
LPL P06858 2/20 0.41
LIPG Q9Y5X9 2/20 0.41
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
THRB P10828 2/20 0.39
CA2 P00918 1/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MITF O75030 1/20 0.38
HPGD P15428 1/20 0.38
KLF5 Q13887 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GPR84 Q9NQS5 1/20 0.38
MGLL Q99685 1/20 0.36
PLK1 P53350 1/20 0.36
SPHK1 Q9NYA1 2/20 0.36
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
NPC1 O15118 1/20 0.35

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
SCHEMBL7228624 1.00 TNNC1 (0.41) TNNC1LPLLIPGCYP4F2CYP4A11
SCHEMBL7240417 0.87 THRB (0.42) TNNC1LPLLIPGCYP4F2CYP4A11
SCHEMBL7240421 0.87 THRB (0.42) TNNC1LPLLIPGCYP4F2CYP4A11
SCHEMBL7237159 0.86 TNNC1 (0.47) TNNC1LPLLIPGCYP4F2CYP4A11
SCHEMBL27497964 0.86 LTA4H (0.45) CYP4F2CYP4A11
SCHEMBL7237164 0.86 TNNC1 (0.47) TNNC1LPLLIPGCYP4F2CYP4A11
SCHEMBL27618886 0.83 TNNC1 (0.48) TNNC1LPLLIPGCYP4F2CYP4A11
SCHEMBL7232016 0.83 ALDH1A1 (0.45) TNNC1LPLLIPGTHRBCA2
SCHEMBL7232012 0.83 ALDH1A1 (0.45) TNNC1LPLLIPGTHRBCA2
SCHEMBL7241048 0.82 TNNC1 (0.55) TNNC1LPLLIPGCYP4F2CYP4A11

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