SCHEMBL336626

SCHEMBL336626

CC(C[Al](CC(C)C(C)(C)c1ccccc1)CC(C)C(C)(C)c1ccccc1)C(C)(C)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 4/20 0.40
CYP3A4 P08684 2/20 0.40
ALDH1A1 P00352 3/20 0.39
CYP2C19 P33261 2/20 0.39
HSD17B10 Q99714 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
MAPK1 P28482 1/20 0.37
HIF1A Q16665 1/20 0.35
ALOX15 P16050 1/20 0.34
RIPK1 Q13546 1/20 0.34
ESR1 P03372 2/20 0.33
ESR2 Q92731 2/20 0.33
KCNN4 O15554 1/20 0.33
CYP1A2 P05177 1/20 0.33
CHRM2 P08172 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
KCNH2 Q12809 2/20 0.33
LMNA P02545 1/20 0.33
TRPA1 O75762 1/20 0.32

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
SCHEMBL6906374 0.84 RIPK1 (0.33) CYP2D6CYP3A4ALDH1A1CYP2C19HSD17B10
SCHEMBL6682969 0.78 KIF11 (0.42) CYP2D6CYP3A4ALDH1A1CYP2C19HSD17B10
SCHEMBL15821748 0.77 CYP2D6 (0.41) CYP2D6CYP3A4ALDH1A1CYP2C19HSD17B10
SCHEMBL28312162 0.77 CYP2D6 (0.44) CYP2D6CYP3A4ALDH1A1CYP2C19HSD17B10
SCHEMBL28500872 0.77 CYP2D6 (0.41) CYP2D6CYP3A4ALDH1A1CYP2C19HSD17B10
SCHEMBL4447199 0.77 CYP2D6 (0.41) CYP2D6CYP3A4ALDH1A1CYP2C19HSD17B10
SCHEMBL6546209 0.75 SIGMAR1 (0.48) CYP2D6TAAR1MAPK1KCNH2LMNA
Hydrogen Peroxide SCHEMBL9456643 0.73 ALDH1A1 (0.42) CYP2D6CYP3A4ALDH1A1CYP2C19HSD17B10
SCHEMBL575235 0.72 MAPK1 (0.46) CYP2D6CYP3A4ALDH1A1CYP2C19HSD17B10
SCHEMBL9279074 0.72 MAPK1 (0.46) CYP2D6CYP3A4ALDH1A1CYP2C19HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1141049-B1 CATALYST SYSTEM FOR OLEFIN POLYMERIZATION BASELL POLYOLEFINE GMBH (DE) 2004-06-09 EP claimed
US-6395668-B1 COORDINATION CATALYSTS BASELL TECHNOLOGY COMPANY BV (NL) 2002-05-28 US claimed
US-6372684-B1 COORDINATION CATALYSTS COMPRISING ZIRCONIUM, TITANIUM, OR HAFNIUM METAL COMPLEX WITH BIS-AMIDO COMPOUND; BORON COMPOUND COCATALYST; AND ORGANOALUMINUM COMPOUNDS; ADDITION POLYMERIZATION; CATALYST SELECTIVITY SHELL OIL COMPANY 2002-04-16 US claimed
US-20020035219-A1 Catalyst system for alpha-olefin oligomerization HORTON ANDREW D (NL) 2002-03-21 US claimed
EP-1141049-A1 CATALYST SYSTEM FOR OLEFIN POLYMERIZATION Basell Technology Company B.V. (NL) 2001-10-10 EP claimed
EP-1073521-A1 CATALYST SYSTEM FOR ALPHA-OLEFIN OLIGOMERIZATION SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 2001-02-07 EP claimed
WO-2000035974-A1 CATALYST SYSTEM FOR OLEFIN POLYMERIZATION BASELL TECHNOLOGY COMPANY B.V. (NL) 2000-06-22 WO claimed
WO-1999052631-A1 CATALYST SYSTEM FOR α-OLEFIN OLIGOMERIZATION SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 1999-10-21 WO claimed
US-20250059362-A1 SOFT POLYOLEFIN COMPOSITION BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2025-02-20 US disclosed
EP-4453088-A1 SOFT POLYOLEFIN COMPOSITION Basell Poliolefine Italia S.r.l. (IT) 2024-10-30 EP disclosed
CN-118401602-A Soft polyolefin composition 巴塞尔聚烯烃意大利有限公司 2024-07-26 CN disclosed
EP-3694811-B1 SUPPORTED CATALYST SYSTEM BASELL POLYOLEFINE GMBH (DE) 2024-04-03 EP disclosed
US-11872548-B2 Oxo-nitrogenated iron complex, catalytic system comprising said oxo-nitrogenated iron complex and process for the (co)polymerization of conjugated dienes VERSALIS S.P.A. (IT) 2024-01-16 US disclosed
US-20230416436-A1 STEREOBLOCK DIENE COPOLYMERS AND PREPARATION PROCESS THEREOF KM TECHNOLOGIES GMBH (CH) 2023-12-28 US disclosed
EP-1017729-A2 PROCESS FOR THE PREPARATION OF SUBSTANTIALLY AMORPHOUS ALPHA-OLEFIN POLYMERS, COMPOSITIONS CONTAINING THEM AND PROCESS FOR THE PREPARATION OF BRIDGED LIGAND Montell Technology Company bv (NL) 2000-07-12 EP disclosed
WO-2000031088-A1 BRIDGED METALLOCENES, PREPARATION, USE IN CATALYTIC SYSTEMS MONTELL TECHNOLOGY COMPANY BV (NL) 2000-06-02 WO disclosed
WO-2000001738-A2 PROCESS FOR THE PREPARATION OF SUBSTANTIALLY AMORPHOUS ALPHA-OLEFIN POLYMERS, COMPOSITIONS CONTAINING THEM AND PROCESS FOR THE PREPARATION OF BRIDGED LIGAND MONTELL TECHNOLOGY COMPANY BV (NL) 2000-01-13 WO disclosed
WO-1999052631-A1 CATALYST SYSTEM FOR α-OLEFIN OLIGOMERIZATION SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 1999-10-21 WO disclosed
EP-0948549-A2 CATALYSTS AND PROCESSES FOR THE POLYMERIZATION OF OLEFINS Montell Technology Company bv (NL) 1999-10-13 EP disclosed
WO-1999021899-A1 CATALYSTS AND PROCESSES FOR THE POLYMERIZATION OF OLEFINS MONTELL TECHNOLOGY COMPANY B.V. (NL) 1999-05-06 WO disclosed