SCHEMBL944607

SCHEMBL944607

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

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 1/20 0.32
BBOX1 O75936 1/20 0.30
EHMT2 Q96KQ7 1/20 0.30
EHMT1 Q9H9B1 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
SCHEMBL29395660 0.87 ALDH1A1 (0.40) CYP3A4TDP1ALDH1A1BBOX1EHMT2
Hydrochloric Acid SCHEMBL1498089 0.83 ALDH1A1 (0.38) CYP3A4TDP1ALDH1A1BBOX1EHMT2
Fluoride Ion SCHEMBL3891341 0.83 ALDH1A1 (0.39) CYP3A4TDP1ALDH1A1BBOX1EHMT2
SCHEMBL29130047 0.81 CYP3A4 (0.33) CYP3A4TDP1ALDH1A1
SCHEMBL2863077 0.81 CYP3A4 (0.33) CYP3A4TDP1ALDH1A1
SCHEMBL4817504 0.77 CYP3A4 (0.30) CYP3A4TDP1
SCHEMBL30572496 0.75 ALDH1A1 (0.32) ALDH1A1
SCHEMBL3292756 0.75 ALDH1A1 (0.39) ALDH1A1
SCHEMBL3984229 0.75 TSHR (0.35) ALDH1A1BBOX1EHMT2EHMT1
SCHEMBL201905 0.71 ALDH1A1 (0.35) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8497331-B2 Polymerisation of ethylene and alpha-olefins with pyrrol-iminophenol complexes TOTAL PETROCHEMICALS RESEARCH FELUY (BE) 2013-07-30 US claimed
EP-1899060-B1 CATALYST SYSTEMS BASED ON MACROCYCLIC LIGANDS TOTAL RES & TECHNOLOGY FELUY (BE) 2012-10-10 EP claimed
EP-1155050-B1 POLYOLEFIN PRODUCTION TOTAL PETROCHEMICALS RES FELUY (BE) 2007-02-14 EP claimed
US-6630546-B1 Linear low-density polyolefin, comprising: reacting an olefin monomer with hydrogen and an alpha-olefin co- monomer in a slurry polymerization in the presence of a catalyst comprising: metallocene catalyst component of general formula FINA RESEARCH, S.A. (BE) 2003-10-07 US claimed
US-6559089-B1 An alumoxane is dissolved in a hydrocarbon solvent; an inert support is slurried in a hydrocarbon solvent; the metallocene catalyst component is added to the slurry FINA TECHNOLOGY, INC. 2003-05-06 US claimed
EP-1155050-A1 POLYOLEFIN PRODUCTION ATOFINA Research (BE) 2001-11-21 EP claimed
WO-2000001736-A1 POLYOLEFIN PRODUCTION FINA RESEARCH S.A. (BE) 2000-01-13 WO claimed
EP-0969019-A1 Polyolefin production FINA RESEARCH S.A. (BE) 2000-01-05 EP claimed
EP-3180368-B2 PROCESS FOR PREPARING A POLYETHYLENE PRODUCT TOTALENERGIES ONETECH BELGIUM (BE) 2022-07-27 EP disclosed
US-11208510-B2 High purity polypropylenes and polypropylene compositions for molding TOTAL RESEARCH & TECHNOLOGY FELUY (BE) 2021-12-28 US disclosed
EP-3568420-B1 HIGH PURITY POLYPROPYLENES AND POLYPROPYLENE COMPOSITIONS FOR MOLDING TOTAL RES & TECHNOLOGY FELUY (BE) 2020-11-18 EP disclosed
US-10544245-B1 Process for preparing a polyethylene product TOTAL RESEARCH & TECHNOLOGY FELUY (BE) 2020-01-28 US disclosed
EP-3568420-A1 HIGH PURITY POLYPROPYLENES AND POLYPROPYLENE COMPOSITIONS FOR MOLDING Total Research & Technology Feluy (BE) 2019-11-20 EP disclosed
US-20180346618-A1 Long Chain Branched Polypropylene TOTAL RES & TECHNOLOGY FELUY (BE) 2018-12-06 US disclosed
US-5243002-A Process and catalyst for producing syndiotactic polymers FINA TECHNOLOGY, INC. (US) 1993-09-07 US disclosed
US-5225500-A Coordination catalyst FINA TECHNOLOGY, INC. (US) 1993-07-06 US disclosed
US-5223468-A Process and catalyst for producing syndiotactic polymers FINA TECHNOLOGY, INC. (US) 1993-06-29 US disclosed
US-5162278-A Non-bridged syndiospecific metallocene catalysts and polymerization process FINA TECHNOLOGY, INC. (US) 1992-11-10 US disclosed
US-5155080-A Metallocene catalyst FINA TECHNOLOGY, INC. (US) 1992-10-13 US disclosed
EP-0427696-A2 Process and catalyst for producing syndiotactic polymers FINA TECHNOLOGY, INC. (US) 1991-05-15 EP disclosed