SCHEMBL133985

SCHEMBL133985

C[NH+](C)c1ccccc1.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 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
KIF11 P52732 1/20 0.38
TACR1 P25103 11/20 0.38
P2RX1 P51575 1/20 0.35
IDO1 P14902 1/20 0.35
TDO2 P48775 1/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
NFKB1 P19838 1/20 0.33
RAB9A P51151 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
Ammonia Solution, Strong SCHEMBL1076938 0.98 ALDH1A1 (0.38) ALDH1A1TSHRKIF11TACR1P2RX1
SCHEMBL6142384 0.98 ALDH1A1 (0.38) ALDH1A1TSHRKIF11TACR1P2RX1
SCHEMBL7458862 0.88 TACR1 (0.33) ALDH1A1TSHRKIF11TACR1P2RX1
SCHEMBL6054049 0.87 NPC1 (0.33) ALDH1A1TSHRKIF11TACR1NPC1
SCHEMBL6054055 0.86 NPC1 (0.32) TACR1NPC1MAPTNFKB1RAB9A
SCHEMBL6054104 0.86 NPC1 (0.32) TACR1NPC1MAPTNFKB1RAB9A
SCHEMBL7878248 0.84 KIF11 (0.48) ALDH1A1TSHRKIF11NPC1MAPT
SCHEMBL6054133 0.84 TACR1 (0.31) TACR1NPC1MAPTNFKB1RAB9A
SCHEMBL6053921 0.84 TACR1 (0.33) TACR1NPC1MAPTNFKB1RAB9A
Diethylaniline SCHEMBL218850 0.83 TACR1 (0.38) ALDH1A1TSHRKIF11TACR1P2RX1

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

Appears in 3718 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12637558-B2 Syndiotactic propylene-based ethylene-propylene copolymers EXXONMOBIL CHEMICAL PATENTS INC. (US) 2026-05-26 US claimed
EP-4610283-A1 ETHYLENE/ALPHA OLEFIN COPOLYMER AND PREPARATION METHOD THEREFOR China Petroleum & Chemical Corporation (CN) 2025-09-03 EP claimed
EP-3697822-B1 MIXED CATALYSTS WITH UNBRIDGED HAFNOCENES WITH -CH2-SIME3 MOIETIES EXXONMOBIL CHEMICAL PATENTS INC (US) 2025-07-30 EP claimed
EP-4587487-A2 CATALYST SYSTEMS AND PROCESSES FOR CYCLIC POLY ALPHA-OLEFINS ExxonMobil Technology and Engineering Company (US) 2025-07-23 EP claimed
CN-114867758-B Metallocene and method thereof 埃克森美孚化学专利公司 2025-04-08 CN claimed
EP-3710491-B1 (DI)SILICON BRIDGED METALLOCENES THAT PRODUCE POLYETHYLENE BROAD MOLECULAR WEIGHT DISTRIBUTION AND MOLECULAR WEIGHT EXXONMOBIL CHEMICAL PATENTS INC (US) 2025-01-01 EP claimed
EP-3365379-B1 PRODUCTION OF POLYOLEFINS WITH INTERNAL UNSATURATION STRUCTURES USING A METALLOCENE CATALYST SYSTEM EXXONMOBIL CHEMICAL PATENTS INC (US) 2024-12-18 EP claimed
WO-2024088341-A1 ETHYLENE/α OLEFIN COPOLYMER AND PREPARATION METHOD THEREFOR 中国石油化工股份有限公司 2024-05-02 WO claimed
EP-4110834-B1 ANSA-BIS(INDEN-2-YL) CATALYSTS FOR PRODUCING VINYLIDENE-TERMINATED POLYALPHAOLEFINS EXXONMOBIL CHEMICAL PATENTS INC (US) 2024-04-03 EP claimed
WO-2024059737-A2 CATALYST SYSTEMS AND PROCESSES FOR CYCLIC POLY ALPHA-OLEFINS ExxonMobil Technology and Engineering Company (US) 2024-03-21 WO claimed
JP-2003531957-A 2003-10-28 JP claimed
US-20030120006-A1 In mold addition polymerization of norbornene-type monomers using group 10 metal complexes THE B.F. GOODRICH COMPANY 2003-06-26 US claimed
EP-1278756-A1 POLYMERIZATION CATALYST COMPOSITIONS AND PROCESSES TO PRODUCE POLYMERS AND BIMODAL POLYMERS Phillips Petroleum Company (US) 2003-01-29 EP claimed
US-6362309-B1 COORDINATION CATALYST SYMYX TECHNOLOGIES, INC. 2002-03-26 US claimed
EP-1155057-A1 IN MOLD ADDITION POLYMERIZATION OF NORBORNENE-TYPE MONOMERS USING GROUP 10 METAL COMPLEXES The B.F.Goodrich Co. (US) 2001-11-21 EP claimed
WO-2001083498-A1 POLYMERIZATION CATALYST COMPOSITIONS AND PROCESSES TO PRODUCE POLYMERS AND BIMODAL POLYMERS PHILLIPS PETROLEUM COMPANY (US) 2001-11-08 WO claimed
WO-2000059961-A1 POLYMERIZATION CATALYST LIGANDS, CATALYTIC METAL COMPLEXES AND COMPOSITIONS AND PROCESSES USING AND METHODS OF MAKING SAME SYMYX TECHNOLOGIES, INC. (US) 2000-10-12 WO claimed
WO-2000034344-A1 IN MOLD ADDITION POLYMERIZATION OF NORBORNENE-TYPE MONOMERS USING GROUP 10 METAL COMPLEXES THE B.F.GOODRICH COMPANY (US) 2000-06-15 WO claimed
EP-0813447-B1 BRIDGED BIS-AMIDO GROUP 4 METAL COMPOUNDS IN A CATALYST COMPOSITION SHELL INT RESEARCH (NL) 1998-10-21 EP claimed
US-5444134-A Using a coordination catalyst IDEMITSU KOSAN CO., LTD. (JP) 1995-08-22 US claimed