SCHEMBL2291836

SCHEMBL2291836

CCC(=CCl)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.45
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
ESR1 P03372 3/20 0.39
ESR2 Q92731 2/20 0.39
HDAC1 Q13547 2/20 0.39
HDAC2 Q92769 2/20 0.39
HDAC3 O15379 1/20 0.39
NCOR2 Q9Y618 1/20 0.39
MAOA P21397 2/20 0.38
MAOB P27338 2/20 0.38
CYP19A1 P11511 1/20 0.38
PTGS1 P23219 1/20 0.37
MTNR1A P48039 1/20 0.37
MTNR1B P49286 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
SCHEMBL16787362 1.00 ATM (0.45) ATMCES2CES1ESR1ESR2
SCHEMBL9310720 0.83 CES2 (0.47) ATMCES2CES1ESR1HDAC1
SCHEMBL6027480 0.81 ATM (0.48) ATMCES2CES1ESR1ESR2
SCHEMBL515423 0.81 ATM (0.48) ATMCES2CES1ESR1ESR2
SCHEMBL515424 0.81 ATM (0.48) ATMCES2CES1ESR1ESR2
SCHEMBL10950242 0.80 ESR1 (0.42) ATMCES2CES1ESR1ESR2
SCHEMBL10950238 0.80 ESR1 (0.42) ATMCES2CES1ESR1ESR2
SCHEMBL498532 0.79 ATM (0.52) ATMCES2CES1ESR1ESR2
SCHEMBL11207094 0.79 HDAC1 (0.55) CES2CES1HDAC1HDAC2HDAC3
SCHEMBL6159704 0.77 ATM (0.45) ATMCES2CES1ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1997037745-A1 FOAM FILTER MATERIAL AND PROCESS TO PREPARE FOAM FILTER MATERIAL SHELL OIL COMPANY (US) 1997-10-16 WO claimed
US-8399154-B2 Method for producing an anion-exchange membrane for a solid polymer electrolyte type fuel cell TOKUYAMA CORPORATION (JP) 2013-03-19 US disclosed
US-20110207028-A1 Method for Producing an Anion-Exchange Membrane for a Solid Polymer Electrolyte Type Fuel Cell TOKUYAMA CORPORATION (JP) 2011-08-25 US disclosed
US-20080199933-A1 Amine Oxidase Inhibitors SAYRE LAWRENCE M 2008-08-21 US disclosed
WO-2008031719-A1 UV-STABILIZERS FOR PLASTICS BASF SE (DE) 2008-03-20 WO disclosed
WO-2004097078-A1 ELECTROLYTIC PROCESSING APPARATUS AND METHOD EBARA CORPORATION (JP) 2004-11-11 WO disclosed
EP-0710245-A1 LINEAR SUBSTITUTED OLIGOALKYLENEIMINE LIBRARIES TORREY PINES INSTITUTE FOR MOLECULAR STUDIES (US) 1996-05-08 EP disclosed
EP-0710245-A4 LINEAR SUBSTITUTED OLIGOALKYLENEIMINE LIBRARIES TORREY PINES INST (US) 1996-03-12 EP disclosed
EP-0684958-A1 POLYMERS CONTAINING GUANIDINO GROUPS FOR USE IN THERAPY BTG INTERNATIONAL LIMITED (GB) 1995-12-06 EP disclosed
EP-0665866-A1 PROCESS FOR PREPARING LOW DENSITY POROUS CROSSLINKED POLYMERIC MATERIALS SHELL OIL COMPANY (US) 1995-08-09 EP disclosed
WO-1994026775-A1 LINEAR SUBSTITUTED OLIGOALKYLENEIMINE LIBRARIES HOUGHTEN PHARMACEUTICALS, INC. (US) 1994-11-24 WO disclosed
WO-1994019379-A1 POLYMERIC COMPOUNDS BRITISH TECHNOLOGY GROUP LIMITED (GB) 1994-09-01 WO disclosed
US-5326489-A Sulfonated polymer NIPPON SHOKUBAI CO., LTD. (JP) 1994-07-05 US disclosed
WO-1994009061-A1 PROCESS FOR PREPARING LOW DENSITY POROUS CROSSLINKED POLYMERIC MATERIALS SHELL OIL COMPANY (US) 1994-04-28 WO disclosed
EP-0523300-B1 Electrorheological fluids NIPPON CATALYTIC CHEM IND (JP) 1994-01-19 EP disclosed
EP-0523300-A1 Electrorheological fluids NIPPON SHOKUBAI KAGAKU KOGYO CO. LTD. (JP) 1993-01-20 EP disclosed
WO-1983004038-A1 POLYESTER COMPOSITION ETHYL CORPORATION (US) 1983-11-24 WO disclosed