SCHEMBL4447790

SCHEMBL4447790

CC(c1ccc(C(C)(C)C)cc1C(C)(C)C)c1ccc(C(C)(C)C)cc1C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NPC1 O15118 1/20 0.38
PLA2G1B P04054 1/20 0.38
NFKB1 P19838 1/20 0.38
CASP3 P42574 1/20 0.38
RAB9A P51151 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ATG4B Q9Y4P1 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
TSHR P16473 3/20 0.37
CYP1A2 P05177 2/20 0.37

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
SCHEMBL30624476 0.87 ALDH1A1 (0.40) ALDH1A1HPGDALOX15HSD17B10TDP1
Hydrogen Peroxide SCHEMBL29245572 0.83 ALDH1A1 (0.42) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL7943128 0.83 ALDH1A1 (0.45) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL28532482 0.81 ALDH1A1 (0.43) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL9355749 0.78 TRPA1 (0.42) ALDH1A1TSHRCYP1A2CYP2C19CYP2C9
SCHEMBL9860514 0.78 TSHR (0.37) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL28020196 0.77 AKR1C3 (0.44) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL52009 0.77 ALDH1A1 (0.59) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL4342097 0.76 ALDH1A1 (0.39) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL9510080 0.75 CYP2C19 (0.49) ALDH1A1HPGDALOX15HSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3347365-B1 HYDROFORMYLATION CATALYST CONTAINING ISOMERICALLY ENRICHED HALOPHOSPHITE EASTMAN CHEM CO (US) 2019-10-09 EP claimed
EP-2796495-B1 METHOD OF PRODUCING OLEFIN RESIN COMPOSITION ADEKA CORP (JP) 2018-07-04 EP claimed
EP-0743574-B1 Migration imaging members XEROX CORP (US) 2000-12-27 EP claimed
EP-0743573-B1 Method for obtaining image contrast migration imaging members XEROX CORP (US) 2000-09-06 EP claimed
US-5844026-A N,N',N''-tris{2,4-bis Hydrocarbyloxy-2,2,6,6-tetra-methylpiperidin-4-yl)alkylamino!-s-triazin-6-yl}-3,3'-ethylenediiminodipropylamines, their isomers and bridged derivatives and polymer compositions stabilized therewith CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-12-01 US claimed
EP-0416321-B1 Crystalline polyolefin composition CHISSO CORP (JP) 1994-11-09 EP claimed
EP-0280938-B1 Antioxidant aromatic fluorophosphites ETHYL CORP (US) 1994-06-15 EP claimed
CN-101977949-A Polymeric compositions for plastic strapping BASF CORP 2011-02-16 CN disclosed
EP-1669405-B1 VINYL CHLORIDE BASED RESIN COMPOSITION FOR VEHICLE ADEKA CORP (JP) 2009-06-10 EP disclosed
US-7361704-B2 Vinyl chloride resin composition for vehicles ADEKA CORPORATION (JP) 2008-04-22 US disclosed
EP-1869507-A2 DIFFUSE REFLECTIVE POLARIZIING FILMS WITH ORIENTABLE POLYMER BLENDS 3M Innovative Properties Company (US) 2007-12-26 EP disclosed
WO-2006107970-A2 DIFFUSE REFLECTIVE POLARIZIING FILMS WITH ORIENTABLE POLYMER BLENDS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-10-12 WO disclosed
US-20060226562-A1 Diffuse reflective polarizing films with orientable polymer blends 3M INNOVATIVE PROPERTIES COMPANY 2006-10-12 US disclosed
US-20010004657-A1 OLEFIN(CO-) POLYMER COMPOSITIONS AND METHOD FOR PRODUCING THE SAME ANDCATALYST FOR OLEFIN (CO-) POLYMERIZATION AND METHOD FOR PRODUCING THE SAME CHISSO CORPORATION (JP) 2001-06-21 US disclosed
US-6156845-A Polyolefin composition and method of making CHISSO CORPORATION (JP) 2000-12-05 US disclosed
US-RE36128-E STABILIZER FOR ORGANIC COMPOUNDS ALBEMARLE CORPORATION (US) 1999-03-02 US disclosed
EP-0856526-A1 OLEFIN (CO)POLYMER COMPOSITION, PROCESS FOR PRODUCING THE SAME, CATALYST FOR (CO)POLYMERIZING OLEFIN, AND PROCESS FOR PRODUCING THE SAME CHISSO CORPORATION (JP) 1998-08-05 EP disclosed
EP-0280938-B1 Antioxidant aromatic fluorophosphites ETHYL CORP (US) 1994-06-15 EP disclosed
US-4912155-A Containing substituted aryl group ETHYL CORPORATION (US) 1990-03-27 US disclosed
EP-0357048-A2 Process for transhalogenating a halophosphorus compound with hydrogen fluoride ALBEMARLE CORPORATION (US) 1990-03-07 EP disclosed