SCHEMBL139663

SCHEMBL139663

C[NH+](C)c1ccccc1.c1ccc([B-](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
RECQL P46063 1/20 0.31
BLM P54132 1/20 0.31
ATM Q13315 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL135100 0.87 ACHE (0.40) ALDH1A1LMNAMAPT
Diethylaniline SCHEMBL9060443 0.86 ALDH1A1 (0.31) ALDH1A1LMNANPSR1
SCHEMBL5048900 0.85 NFE2L2 (0.34)
Trimethylammonium SCHEMBL216520 0.84 ALDH1A1 (0.39) ALDH1A1LMNATP53MAPTTHRB
SCHEMBL8979454 0.83 ALDH1A1 (0.43) ALDH1A1
SCHEMBL29614954 0.82 ACHE (0.39) ALDH1A1LMNAMAPTNPSR1
SCHEMBL7455798 0.82
SCHEMBL7460569 0.82
SCHEMBL134649 0.82 ACHE (0.39) ALDH1A1LMNAMAPTNPSR1
SCHEMBL8979438 0.82 LMNA (0.35) ALDH1A1LMNATP53

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 3245 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114867758-B Metallocene and method thereof 埃克森美孚化学专利公司 2025-04-08 CN claimed
WO-2024204958-A1 CATALYST COMPOSITION FOR PRODUCING ETHYLENE-BASED POLYMER APPLICABLE TO HIGH-TEMPERATURE SOLUTION PROCESS, AND METHOD FOR PRODUCING ETHYLENE-BASED POLYMER USING SAME 한화토탈에너지스 주식회사 2024-10-03 WO claimed
US-11760814-B2 1,5 diazabicyclooctane ligand systems and methods therewith EXXONMOBIL CHEMICAL PATENTS INC. (US) 2023-09-19 US claimed
EP-4222180-A1 BIS(HETEROCYCLIC-OLATE) LEWIS BASE CATALYSTS AND METHODS THEREOF ExxonMobil Chemical Patents Inc. (US) 2023-08-09 EP claimed
EP-4196507-A1 CYCLIC CONTAINING POLYMER COMPOSITIONS OBTAINED USING TRANSITION METAL BIS(PHENOLATE) CATALYST COMPLEXES AND PROCESS FOR PRODUCTION THEREOF ExxonMobil Chemical Patents Inc. (US) 2023-06-21 EP claimed
US-11560441-B2 Method for preparing polyolefin using supported hybrid metallocene catalyst LG CHEM, LTD. 2023-01-24 US claimed
EP-4103630-A1 PROPYLENE COPOLYMERS OBTAINED USING TRANSITION METAL BIS(PHENOLATE) CATALYST COMPLEXES AND HOMOGENEOUS PROCESS FOR PRODUCTION THEREOF ExxonMobil Chemical Patents Inc. (US) 2022-12-21 EP claimed
EP-4103628-A1 PROPYLENE POLYMERS OBTAINED USING TRANSITION METAL BIS(PHENOLATE) CATALYST COMPLEXES AND HOMOGENEOUS PROCESS FOR PRODUCTION THEREOF ExxonMobil Chemical Patents Inc. (US) 2022-12-21 EP claimed
EP-4103631-A1 ETHYLENE-ALPHA-OLEFIN-DIENE MONOMER COPOLYMERS OBTAINED USING TRANSITION METAL BIS(PHENOLATE) CATALYST COMPLEXES AND HOMOGENEOUS PROCESS FOR PRODUCTION THEREOF ExxonMobil Chemical Patents Inc. (US) 2022-12-21 EP claimed
EP-4103629-A1 POLYETHYLENE COMPOSITIONS OBTAINED USING TRANSITION METAL BIS(PHENOLATE) CATALYST COMPLEXES AND HOMOGENEOUS PROCESS FOR PRODUCTION THEREOF ExxonMobil Chemical Patents Inc. (US) 2022-12-21 EP 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
EP-1015501-A1 POLYMERISATION CATALYSTS BP Chemicals Limited (GB) 2000-07-05 EP claimed
EP-0953571-A1 Catalysts for olefin polymerisation BP Chemicals Limited (GB) 1999-11-03 EP claimed
WO-1999046304-A1 POLYMERISATION CATALYST BP CHEMICALS LIMITED (GB) 1999-09-16 WO claimed
WO-1999012981-A1 POLYMERISATION CATALYSTS BP CHEMICALS LIMITED (GB) 1999-03-18 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
EP-0813447-A1 BRIDGED BIS-AMIDO GROUP 4 METAL COMPOUNDS IN A CATALYST COMPOSITION SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1997-12-29 EP claimed
EP-0418044-B1 Metal complex compounds, process for preparation and method of use DOW CHEMICAL CO (US) 1997-09-10 EP claimed
EP-0765882-A2 Metal complex compounds, process for preparation and method of use THE DOW CHEMICAL COMPANY (US) 1997-04-02 EP claimed
WO-1996027439-A1 BRIDGED BIS-AMIDO GROUP 4 METAL COMPOUNDS IN A CATALYST COMPOSITION SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 1996-09-12 WO claimed