SCHEMBL529864

SCHEMBL529864

CCC(C)(C)OOC(C)(CC(=O)O)OOC(C)(C)CC

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.41
CHRM1 P11229 1/20 0.41
TBXA2R P21731 1/20 0.41
ADRA1A P35348 1/20 0.41
TSHR P16473 3/20 0.39
CYP2C19 P33261 2/20 0.39
HIF1A Q16665 2/20 0.39
CYP2D6 P10635 1/20 0.39
TDP1 Q9NUW8 2/20 0.35
KDM4E B2RXH2 1/20 0.35
FFAR1 O14842 1/20 0.35
CPT2 P23786 1/20 0.35
ALDH1A1 P00352 2/20 0.33
FFAR3 O14843 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
SCHEMBL464959 0.79 HMGCR (0.46) HMGCRCHRM1TBXA2RADRA1ATSHR
SCHEMBL9148867 0.79 TSHR (0.37) TSHRTDP1ALDH1A1
SCHEMBL22150 0.79 ALDH1A1 (0.42) TSHRHIF1ATDP1FFAR1ALDH1A1
Acetic Acid SCHEMBL29229984 0.79 TSHR (0.41) HMGCRCHRM1TBXA2RADRA1ATSHR
SCHEMBL24168 0.78 GAA (0.41) TSHRALDH1A1
SCHEMBL30473240 0.77 TSHR (0.43) TSHRTDP1ALDH1A1
Acetic Acid SCHEMBL25274821 0.76 HMGCR (0.42) HMGCRCHRM1TBXA2RADRA1ATSHR
SCHEMBL9717600 0.75 GAA (0.39) TSHRALDH1A1
SCHEMBL1469705 0.74 GAA (0.38) TSHRCYP2C19ALDH1A1
SCHEMBL1421407 0.73 TSHR (0.52) TSHRTDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3755675-B1 ACCELERATED PEROXIDE-CURED RESIN COMPOSITIONS HAVING EXTENDED OPEN TIMES ARKEMA INC (US) 2026-05-13 EP claimed
EP-3360927-B1 PHA COMPOSITIONS COMPRISING PBS AND PBSA AND METHOD FOR PRODUCING THE COMPOSITIONS CJ CHEILJEDANG CORP (KR) 2020-09-09 EP claimed
EP-2571936-B1 TOUGHENING POLYLACTIC ACID WITH POLYHYDROXYALKANOATES CJ CHEILJEDANG CORP (KR) 2019-02-06 EP claimed
EP-3002312-B1 CURABLE COMPOSITIONS REICHHOLD LLC 2 (US) 2018-08-29 EP claimed
EP-2817379-B1 ADHESIVE FOR PRODUCING COMPOUND BODIES, PRIMARILY A PLASTIC-GLASS COMPOUND OR COMPOUND GLASS, FOR ARCHITECTURE AND CONSTRUCTION EVONIK ROEHM GMBH (DE) 2016-04-13 EP claimed
EP-2010575-B1 PROCESS OF FREE-RADICAL POLYMERIZATION OR CROSSLINKING IN THE PRESENCE OF A SELECTED ORGANIC PEROXIDE PREPARED BY AN EX SITU PROCESS ARKEMA FRANCE (FR) 2015-07-01 EP claimed
EP-2291429-B1 BRANCHED PHA COMPOSITIONS, METHODS FOR THEIR PRODUCTION, AND USE IN APPLICATIONS METABOLIX INC (US) 2013-06-05 EP claimed
EP-2010484-B1 PROCESS FOR SYNTHESIZING SELECTED ORGANIC PEROXIDES ARKEMA FRANCE (FR) 2012-09-19 EP claimed
EP-1360069-B1 IN SITU MICROENCAPSULATED ADHESIVE APPLETON PAPER INC (US) 2010-02-10 EP claimed
EP-1770119-B1 Crosslinkabe elastomer compositions, process for preparation, and use thereof LANXESS DEUTSCHLAND GMBH (DE) 2009-11-25 EP claimed
EP-1192192-B1 METHOD FOR THE PRODUCTION OF A CONTROLLED RHEOLOGICAL POLYPROPYLENE RESIN ATOFINA (FR) 2003-03-26 EP claimed
EP-0768156-B1 Process for polymer degradation UNION CARBIDE CHEM PLASTIC (US) 2002-08-21 EP claimed
EP-0504920-B1 Scorch retarding curing/crosslinking compositions ATOCHEM NORTH AMERICA ELF (US) 1998-07-08 EP claimed
EP-0423639-B1 Peroxide masterbatches using polycaprolactone as the carrier ATOCHEM NORTH AMERICA (US) 1995-09-20 EP claimed
EP-0273090-B1 SOLUTION POLYMERIZATION OF ACRYLIC ACID DERIVED MONOMERS USING TERTIARY ALKYL( C5)-HYDROPEROXIDES ATOCHEM NORTH AMERICA, INC. (a Pennsylvania corp.) (US) 1992-03-18 EP claimed
EP-4081410-B1 NOVEL RUBBER COMPOSITION FOR A TYRE MICHELIN & CIE (FR) 2026-05-27 EP disclosed
EP-4081411-B1 NOVEL RUBBER COMPOSITION FOR A TYRE MICHELIN & CIE (FR) 2026-05-06 EP disclosed
EP-0273090-A1 Solution polymerization of acrylic acid derived monomers using tertiary alkyl( C5)-hydroperoxides ATOCHEM NORTH AMERICA, INC. (a Pennsylvania corp.) (US) 1988-07-06 EP disclosed
EP-0244070-A2 Rapid curing, thermally stable adhesive National Starch and Chemical Investment Holding Corporation (US) 1987-11-04 EP disclosed
US-4652398-A Rapid curing, thermally stable adhesive composition comprising epoxy resin, polyimide, reactive solvent, and crosslinker STAUFFER CHEMICAL COMPANY (US) 1987-03-24 US disclosed