SCHEMBL3858830

SCHEMBL3858830

Cc1cc(C(C)(C)C)c(O)c(S(Cl)(Cl)c2cc(C)cc(C(C)(C)C)c2O)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.65
CA2 P00918 4/20 0.65
ALDH1A1 P00352 4/20 0.65
POLB P06746 1/20 0.65
TYR P14679 1/20 0.65
HSPA5 P11021 1/20 0.53
CYP2C9 P11712 4/20 0.52
CYP2C19 P33261 4/20 0.52
HIF1A Q16665 3/20 0.52
CYP2D6 P10635 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CA1 P00915 2/20 0.45
CYP1A2 P05177 2/20 0.44
TP53 P04637 1/20 0.41
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
MAPT P10636 2/20 0.39
ALOX15 P16050 2/20 0.39
HPN P05981 1/20 0.39
SIRT5 Q9NXA8 1/20 0.39

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
SCHEMBL4896805 0.85 SMN1; SMN2 (0.61) SMN1; SMN2CA2ALDH1A1POLBTYR
Butylated Hydroxytoluene SCHEMBL3950 0.80 SMN1; SMN2 (1.00) SMN1; SMN2CA2ALDH1A1POLBTYR
Butylated Hydroxytoluene SCHEMBL453824 0.80 SMN1; SMN2 (1.00) SMN1; SMN2CA2ALDH1A1POLBTYR
SCHEMBL7200072 0.80 SMN1; SMN2 (0.65) SMN1; SMN2CA2ALDH1A1POLBTYR
Butylated Hydroxytoluene SCHEMBL11859223 0.78 SMN1; SMN2 (0.95) SMN1; SMN2CA2ALDH1A1POLBTYR
Butylated Hydroxytoluene SCHEMBL11857289 0.78 SMN1; SMN2 (0.95) SMN1; SMN2CA2ALDH1A1POLBTYR
Butylated Hydroxytoluene SCHEMBL7075597 0.78 SMN1; SMN2 (0.95) SMN1; SMN2CA2ALDH1A1POLBTYR
Butylated Hydroxytoluene SCHEMBL20660368 0.78 SMN1; SMN2 (0.95) SMN1; SMN2CA2ALDH1A1POLBTYR
Butylated Hydroxytoluene SCHEMBL864242 0.78 SMN1; SMN2 (0.95) SMN1; SMN2CA2ALDH1A1POLBTYR
Butylated Hydroxytoluene SCHEMBL9343307 0.78 SMN1; SMN2 (0.95) SMN1; SMN2CA2ALDH1A1POLBTYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1753792-B1 PROCESS FOR THE PREPARATION OF ATACTIC 1-BUTENE POLYMERS BASELL POLYOLEFINE GMBH (DE) 2009-10-14 EP disclosed
EP-1753792-A1 PROCESS FOR THE PREPARATION OF ATACTIC 1-BUTENE POLYMERS Basell Polyolefine GmbH (DE) 2007-02-21 EP disclosed
WO-2005105865-A1 PROCESS FOR THE PREPARATION OF ATACTIC 1-BUTENE POLYMERS BASELL POLYOLEFINE GMBH (DE) 2005-11-10 WO disclosed
US-6632900-B2 Coordination catalyst SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-10-14 US disclosed
US-6414094-B2 PRODUCING A NONMELTING, C5+ OLEFIN POLYMER OF HIGH MOLECULAR WEIGHT WITH NARROW MOLECULAR WEIGHT DISTRIBUTION BY USING A SPECIFIED TRANSITION METAL COMPOUND CATALYST, AN ORGANOALUMINUMOXY SOLUBLE IN AROMATIC SOLVENT AND WATER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-07-02 US disclosed
US-20020002254-A1 Olefin polymer, olefin polymerization catalyst and process for producing olefin polymer SUMITOMO CHEMICAL COMPANY, LTD. 2002-01-03 US disclosed
US-6288192-B1 POLYBUTYLENE OR BUTYLENE-PROPYLENE COPOLYMER; HIGH MOLECULAR WEIGHT; NO MELTING POINT; COORDINATION CATALYST OF TRANSITION METAL COMPOUND AND ALUMOXANE SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2001-09-11 US disclosed
US-20010009953-A1 Olefin polymer and process for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED. 2001-07-26 US disclosed
US-6232421-B1 USING COORDINATION ORGANOMETALLIC COMPLEX CATALYST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-05-15 US disclosed