SCHEMBL4603712

SCHEMBL4603712

CC(Cc1ccc(Cl)cc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.53
SLC6A3 Q01959 1/20 0.53
ESR1 P03372 1/20 0.52
ESR2 Q92731 1/20 0.52
CYP1A2 P05177 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C19 P33261 1/20 0.49
TAAR1 Q96RJ0 3/20 0.47
SLC6A4 P31645 1/20 0.47
CHRNB2 P17787 1/20 0.45
CHRNA4 P43681 1/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CNR1 P21554 4/20 0.43
CNR2 P34972 4/20 0.43
TDP1 Q9NUW8 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
C3AR1 Q16581 1/20 0.42
AOC3 Q16853 1/20 0.42

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
SCHEMBL4603704 1.00 SLC6A2 (0.53) SLC6A2SLC6A3ESR1ESR2CYP1A2
Ammonia Solution, Strong SCHEMBL8867131 0.98 SLC6A2 (0.52) SLC6A2SLC6A3ESR1ESR2CYP1A2
SCHEMBL29758290 0.92 ESR1 (0.52) SLC6A2SLC6A3ESR1ESR2CYP2D6
Ammonia Solution, Strong SCHEMBL5305670 0.90 ESR1 (0.50) SLC6A2SLC6A3ESR1ESR2CYP2D6
SCHEMBL14219903 0.90 SLC6A2 (0.44) SLC6A2SLC6A3ESR1ESR2CYP1A2
SCHEMBL14219567 0.90 SLC6A2 (0.44) SLC6A2SLC6A3ESR1ESR2CYP1A2
SCHEMBL14220013 0.90 SLC6A2 (0.44) SLC6A2SLC6A3ESR1ESR2CYP1A2
SCHEMBL9069704 0.89 ESR1 (0.61) SLC6A2SLC6A3ESR1ESR2TAAR1
Fumaric Acid SCHEMBL8866318 0.86 TAAR1 (0.48) ESR1ESR2CYP1A2CYP2D6CYP2C19
SCHEMBL6545668 0.86 ESR1 (0.59) SLC6A2SLC6A3ESR1ESR2TAAR1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1650284-B1 Liquid crystal composition containing an optical active compound and liquid crystal electro-optical element SEIMI CHEM KK (JP) 2008-04-30 EP disclosed
EP-1650285-B1 Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element SEIMI CHEM KK (JP) 2008-04-30 EP disclosed
EP-1650286-B1 Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element SEIMI CHEM KK (JP) 2008-04-30 EP disclosed
EP-1371712-B1 LIQUID-CRYSTAL COMPOSITION CONTAINING OPTICALLY ACTIVE COMPOUND AND LIQUID-CRYSTAL ELECTROOPTIC ELEMENT SEIMI CHEM KK (JP) 2007-04-11 EP disclosed
US-7108895-B2 Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element SEIMI CHEMICAL CO., LTD. (JP) 2006-09-19 US disclosed
EP-1650286-A2 Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element Seimi Chemical Co., Ltd. (JP) 2006-04-26 EP disclosed
EP-1650285-A2 Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element Seimi Chemical Co., Ltd. (JP) 2006-04-26 EP disclosed
EP-1650284-A2 Liquid crystal composition containing an optical active compound and liquid crystal electro-optical element Seimi Chemical Co., Ltd. (JP) 2006-04-26 EP disclosed
US-20040079922-A1 Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element SEIMI CHEMICAL CO., LTD. (JP) 2004-04-29 US disclosed
EP-1371712-A1 LIQUID-CRYSTAL COMPOSITION CONTAINING OPTICALLY ACTIVE COMPOUND AND LIQUID-CRYSTAL ELECTROOPTIC ELEMENT Seimi Chemical Co., Ltd. (JP) 2003-12-17 EP disclosed
US-4260506-A Hydraulic pressure device utilizing biodegradable halogenated diphenyl methanes MONSANTO COMPANY (US) 1981-04-07 US disclosed