SCHEMBL456893

SCHEMBL456893

Cc1cccc([NH3+])c1C.FC(F)(F)c1cc([B-](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc(C(F)(F)F)c1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
P2RX1 P51575 1/20 0.36
GPBAR1 Q8TDU6 1/20 0.34
TRPA1 O75762 1/20 0.32
ATM Q13315 1/20 0.32
CMKLR1 Q99788 1/20 0.32
NPC1 O15118 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
RAPGEF4 Q8WZA2 2/20 0.32
GAA P10253 1/20 0.31
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
NFE2L2 Q16236 1/20 0.30
MAPK14 Q16539 1/20 0.30
TACR1 P25103 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL7458854 0.89 P2RX1 (0.32) P2RX1GPBAR1GAA
SCHEMBL1024274 0.78 RAPGEF4 (0.37) TRPA1ATMRAPGEF4TSHR
SCHEMBL815085 0.78 P2RX1 (0.38) P2RX1GPBAR1CMKLR1RAPGEF4GAA
SCHEMBL7459785 0.76 KIF11 (0.31)
SCHEMBL1899051 0.74 TRPA1 (0.35) TRPA1ATMNPC1RAB9ATSHR
SCHEMBL2414540 0.74 MRGPRX4 (0.35) P2RX1GPBAR1TACR1
SCHEMBL5048899 0.73 MEN1 (0.37) TRPA1ATMHTTGAATSHR
SCHEMBL29557826 0.73 RAPGEF4 (0.46) RAPGEF4RXRARXRBMAPK1
SCHEMBL5028488 0.73 ACHE (0.38) TRPA1ATMRAPGEF4TSHRMAPK1
SCHEMBL28411487 0.73 TRPA1 (0.41) TRPA1ATMRAPGEF4NFE2L2TSHR

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 123 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2010577-B1 POLYMERIZATION CATALYSTS FOR PRODUCING POLYMERS WITH LOW LEVELS OF LONG CHAIN BRANCHING CHEVRON PHILLIPS CHEMICAL CO (US) 2010-11-17 EP claimed
EP-2010577-A2 POLYMERIZATION CATALYSTS FOR PRODUCING POLYMERS WITH LOW LEVELS OF LONG CHAIN BRANCHING Chevron Phillips Chemical Company LP (US) 2009-01-07 EP claimed
EP-1989238-A1 DUAL METALLOCENE CATALYSTS FOR POLYMERIZATION OF BIMODAL POLYMERS Chevron Phillips Chemical Company LP (US) 2008-11-12 EP claimed
WO-2007115093-A2 POLYMERIZATION CATALYSTS FOR PRODUCING POLYMERS WITH LOW LEVELS OF LONG CHAIN BRANCHING CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2007-10-11 WO claimed
WO-2007101053-A1 DUAL METALLOCENE CATALYSTS FOR POLYMERIZATION OF BIMODAL POLYMERS CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2007-09-07 WO claimed
JP-2007520597-A 2007-07-26 JP claimed
JP-2007518871-A 2007-07-12 JP claimed
EP-1778749-A2 POLYMERIZATION CATALYSTS FOR PRODUCING POLYMERS WITH LOW LEVELS OF LONG CHAIN BRANCHING Chevron Phillips Chemical Company LP (US) 2007-05-02 EP claimed
EP-1711543-A2 CATALYST COMPOSITIONS AND POLYOLEFINS FOR EXTRUSION COATING APPLICATIONS Chevron Phillips Chemical Company LP (US) 2006-10-18 EP claimed
EP-1706437-A1 DUAL METALLOCENE CATALYST FOR PRODUCING FILM RESINS WITH GOOD MACHINE DIRECTION (MD) ELMENDORF TEAR STRENGTH Chevron Phillips Chemical Company LP (US) 2006-10-04 EP claimed
WO-2006004709-A2 POLYMERIZATION CATALYSTS FOR PRODUCING POLYMERS WITH LOW LEVELS OF LONG CHAIN BRANCHING CHEVRON PHILLIPS CHEMICAL COMPANY, LP (US) 2006-01-12 WO claimed
WO-2005070977-A1 DUAL METALLOCENE CATALYST FOR PRODUCING FILM RESINS WITH GOOD MACHINE DIRECTION (MD) ELMENDORF TEAR STRENGTH CHEVRON PHILLIPS CHEMICAL COMPANY, LP (US) 2005-08-04 WO claimed
WO-2005068519-A2 CATALYST COMPOSITIONS AND POLYOLEFINS FOR EXTRUSION COATING APPLICATIONS CHEVRON PHILLIPS CHEMICAL COMPANY, LP (US) 2005-07-28 WO claimed
EP-1546223-A2 SUPERCRITICAL POLYMERIZATION PROCESS AND POLYMERS PRODUCED THEREFROM ExxonMobil Chemical Patents Inc. (US) 2005-06-29 EP claimed
WO-2004026923-A2 SUPERCRITICAL POLYMERIZATION PROCESS AND POLYMERS PRODUCED THEREFROM EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-04-01 WO claimed
WO-2024129579-A1 OLIGOMERIZATION OF ALPHA OLEFINS USING SUPPORTED METALLOCENE CATALYSTS IN SELECTIVE PRODUCTION OF VINYLIDENE DIMERS CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2024-06-20 WO disclosed
WO-2023235799-A1 HIGH POROSITY FLUORIDED SILICA-COATED ALUMINA ACTIVATOR-SUPPORTS AND USES THEREOF IN METALLOCENE-BASED CATALYST SYSTEMS FOR OLEFIN POLYMERIZATION CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2023-12-07 WO disclosed
US-5750817-A POLYMERIZATION CATALYSTS FOR OLEFINS USING CATALYSTS OF CHROMIUM, AMINE AND ALUMINUM COORDINATION CATALYSTS MITSUBISHI CHEMICAL CORPORATION (JP) 1998-05-12 US disclosed
EP-0706983-A1 Process for producing alpha-olefin oligomers MITSUBISHI CHEMICAL CORPORATION (JP) 1996-04-17 EP disclosed
EP-0611743-A2 Process for producing alpha-olefin oligomer compositions Mitsubishi Chemical Corporation (JP) 1994-08-24 EP disclosed