SCHEMBL7642945

SCHEMBL7642945

CC1(C)CC(OC(=O)c2ccccc2)CC(C)(C)N1OC(=O)CCCCC(=O)ON1C(C)(C)CC(OC(=O)c2ccccc2)CC1(C)C

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.73
KMT2A Q03164 4/20 0.65
GAA P10253 3/20 0.61
MEN1 O00255 2/20 0.61
ALDH1A1 P00352 1/20 0.50
ESR1 P03372 1/20 0.50
HSD17B10 Q99714 1/20 0.50
CHRNA7 P36544 3/20 0.44
HTR3E A5X5Y0 1/20 0.44
HTR3B O95264 1/20 0.44
HTR3A P46098 1/20 0.44
HTR3D Q70Z44 1/20 0.44
HTR3C Q8WXA8 1/20 0.44
CARM1 Q86X55 1/20 0.42
PRMT6 Q96LA8 1/20 0.42
EPHX2 P34913 1/20 0.41
APOBEC3A P31941 1/20 0.40
APOBEC3G Q9HC16 1/20 0.40
HTT P42858 1/20 0.40
SCN1A P35498 1/20 0.40

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
SCHEMBL1138704 0.99 TSHR (0.71) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL14365439 0.96 TSHR (0.68) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL1138523 0.94 TSHR (0.65) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL1939153 0.89 KMT2A (0.71) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL1138721 0.87 KMT2A (0.84) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL1138526 0.85 TSHR (0.82) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL9440201 0.85 TSHR (0.82) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL9440204 0.85 TSHR (0.82) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL1138480 0.84 TSHR (1.00) TSHRKMT2AGAAMEN1ALDH1A1
SCHEMBL28462516 0.84 TSHR (0.57) TSHRKMT2AGAAMEN1ALDH1A1

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6409887-B1 FOR INHIBITING OLEFINIC POLYMERISATION AAH MARKS AND COMPANY LIMITED (GB) 2002-06-25 US claimed
US-9732168-B2 Method of preparing ethylene polymers by controlled high pressure polymerization BASF SE (DE) 2017-08-15 US disclosed
US-9732168-B2 Method of preparing ethylene polymers by controlled high pressure polymerization BASF SE (DE) 2017-08-15 US disclosed
US-20130150542-A1 Method Of Preparing Ethylene Polymers By Controlled High Pressure Polymerization BASF SE (DE) 2013-06-13 US disclosed
US-20130150542-A1 Method Of Preparing Ethylene Polymers By Controlled High Pressure Polymerization BASF SE (DE) 2013-06-13 US disclosed
EP-1655303-B1 Process for the Controlled Increase in Molecular Weight of Polyethylene or Polyethylene Blends BASF SE (DE) 2011-02-23 EP disclosed
US-7820248-B2 Coating composition comprising hydroxylamine esters CIBA SPECIALTY CHEMICALS CORP. (US) 2010-10-26 US disclosed
US-7820248-B2 Coating composition comprising hydroxylamine esters CIBA SPECIALTY CHEMICALS CORP. (US) 2010-10-26 US disclosed
US-20100210800-A1 METHOD OF PREPARING ETHYLENE POLYMERS BY CONTROLLED HIGH PRESSURE POLYMERIZATION CIBA CORPORATION (US) 2010-08-19 US disclosed
US-20100210800-A1 METHOD OF PREPARING ETHYLENE POLYMERS BY CONTROLLED HIGH PRESSURE POLYMERIZATION CIBA CORPORATION (US) 2010-08-19 US disclosed
US-20080234453-A1 Method of Preparing Ethylene Polymers by Controlled High Pressure Polymerization ROTH MICHAEL 2008-09-25 US disclosed
US-20080234453-A1 Method of Preparing Ethylene Polymers by Controlled High Pressure Polymerization ROTH MICHAEL 2008-09-25 US disclosed
US-7358365-B2 Process for the controlled increase in the molecular weight of polyethylenes CIBA SPECIALTY CHEMICALS CORPORATION (US) 2008-04-15 US disclosed
US-7358311-B2 Crosslinking of unsaturated polymers by the use of hydroxylamine-esters CIBA SPECIALTY CHEMICALS CORP. (US) 2008-04-15 US disclosed
US-7358311-B2 Crosslinking of unsaturated polymers by the use of hydroxylamine-esters CIBA SPECIALTY CHEMICALS CORP. (US) 2008-04-15 US disclosed
US-7230042-B2 Flame retardant polymer compositions containing hydroxylamine esters CIBA SPECIALTY CHEMICALS CORP. (US) 2007-06-12 US disclosed
US-7230042-B2 Flame retardant polymer compositions containing hydroxylamine esters CIBA SPECIALTY CHEMICALS CORP. (US) 2007-06-12 US disclosed