SCHEMBL395090

SCHEMBL395090

CCCCC(=CC(C)(CC)CC)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.39
CES1 P23141 2/20 0.38
CES2 O00748 1/20 0.38
ALDH1A1 P00352 3/20 0.35
AKR1B1 P15121 1/20 0.35
TP53 P04637 1/20 0.35
GPR84 Q9NQS5 7/20 0.34
PPARG P37231 7/20 0.34
PPARD Q03181 7/20 0.34
PPARA Q07869 7/20 0.34
HDAC11 Q96DB2 5/20 0.34
TSHR P16473 4/20 0.34
PTPN1 P18031 3/20 0.34
TLR2 O60603 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
FABP4 P15090 2/20 0.34
SLC22A6 Q4U2R8 1/20 0.34
SLC22A8 Q8TCC7 1/20 0.34
MEN1 O00255 1/20 0.34
ESR1 P03372 1/20 0.34

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
SCHEMBL3143571 0.78 AKR1B1 (0.46) APEX1CES1CES2ALDH1A1AKR1B1
SCHEMBL3143579 0.78 AKR1B1 (0.46) APEX1CES1CES2ALDH1A1AKR1B1
SCHEMBL2416656 0.78 ALDH1A1 (0.41) APEX1CES1CES2ALDH1A1AKR1B1
SCHEMBL3143583 0.78 AKR1B1 (0.46) APEX1CES1CES2ALDH1A1AKR1B1
SCHEMBL2416653 0.78 ALDH1A1 (0.41) APEX1CES1CES2ALDH1A1AKR1B1
SCHEMBL7124107 0.77 GPR84 (0.48) APEX1CES1CES2ALDH1A1AKR1B1
SCHEMBL5271642 0.77 GPR84 (0.48) APEX1CES1CES2ALDH1A1AKR1B1
SCHEMBL88045 0.74 CES1 (0.48) APEX1CES1CES2ALDH1A1AKR1B1
SCHEMBL1287562 0.74 CES1 (0.48) APEX1CES1CES2ALDH1A1AKR1B1
SCHEMBL481537 0.74 CES1 (0.48) APEX1CES1CES2ALDH1A1AKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1551885-B1 PROCESS TO MODIFY POLYMERIC MATERIALS 3M INNOVATIVE PROPERTIES CO (US) 2016-02-17 EP disclosed
US-20120101231-A1 Polymer Composition prepared from acrylic polymer grafted with a functionalized block copolymers KRATON POLYMERS U.S. LLC (US) 2012-04-26 US disclosed
US-8101711-B2 Process to modify polymeric materials and resulting compositions 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-01-24 US disclosed
EP-2197953-A1 END USE APPLICATIONS PREPARED FROM CERTAIN BLOCK COPOLYMERS Kraton Polymers U.S. LLC (US) 2010-06-23 EP disclosed
US-20100130670-A1 END USE APPLICATIONS PREPARED FROM CERTAIN BLOCK COPOLYMERS KRATON POLYMERS US LLC (US) 2010-05-27 US disclosed
WO-2010059298-A1 END USE APPLICATIONS PREPARED FROM CERTAIN BLOCK COPOLYMERS KRATON POLYMERS US LLC (US) 2010-05-27 WO disclosed
US-20100048819-A1 PROCESS TO MODIFY POLYMERIC MATERIALS AND RESULTING COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY 2010-02-25 US disclosed
US-7632916-B2 Thermally induced graft polymerization in an apparatus by shearing, devolatilization; grafting isoprene-t-butyl methacrylate copolymer with polyoxyethylene glycol methyl ether, forming methacrylic acid/anhydride monomers 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-12-15 US disclosed
WO-2009048968-A1 END USE APPLICATIONS PREPARED FROM CERTAIN BLOCK COPOLYMERS KRATON POLYMERS U.S. LLC (US) 2009-04-16 WO disclosed
US-20090093584-A1 End Use Applications Prepared From Certain Block Copolymers KRATON POLYMERS U.S. LLC (US) 2009-04-09 US disclosed
EP-1551885-A2 PROCESS TO MODIFY POLYMERIC MATERIALS AND RESULTING COMPOSITIONS 3M Innovative Properties Company (US) 2005-07-13 EP disclosed
EP-1551547-A1 A CONTINUOUS PROCESS FOR THE PRODUCTION OF COMBINATORIAL LIBRARIES OF MODIFIED MATERIALS 3M Innovative Properties Company (US) 2005-07-13 EP disclosed
WO-2004012858-A1 A CONTINUOUS PROCESS FOR THE PRODUCTION OF COMBINATORIAL LIBRARIES OF MODIFIED MATERIALS 3M INNOVATIVE PROPERTIES COMPANY (US) 2004-02-12 WO disclosed
WO-2004013189-A2 PROCESS TO MODIFY POLYMERIC MATERIALS AND RESULTING COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY (US) 2004-02-12 WO disclosed
US-20040023398-A1 Continuous process for the production of combinatorial libraries of modified materials 3M INNOVATIVE PROPERTIES COMPANY 2004-02-05 US disclosed
US-20040024130-A1 Process to modify polymeric materials and resulting compositions 3M INNOVATIVE PROPERTIES COMPANY 2004-02-05 US disclosed
US-5338802-A Low temperature conversion of polymerized esters SHELL OIL COMPANY (US) 1994-08-16 US disclosed
EP-0603965-A2 Modified block copolymers and process for the preparation thereof SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1994-06-29 EP disclosed
EP-0569100-A1 Polymers having stable anhydride rings SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1993-11-10 EP disclosed
US-5218053-A Anionically polymerizing conjugated alkadienes or alkenyl aromatics and an unsaturated ester; hydrogenating; heating to cyclize SHELL OIL COMPANY (US) 1993-06-08 US disclosed