SCHEMBL6294580

SCHEMBL6294580

CCCCCCCC=C1CC(=O)OC1=O

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.44
PRKCA P17252 11/20 0.43
PPARG P37231 2/20 0.42
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
ABHD16A O95870 1/20 0.40
CDC25A P30304 1/20 0.39
CDC25B P30305 1/20 0.39
CDC25C P30307 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
SCHEMBL6730512 1.00 TYR (0.44) TYRPRKCAPPARGALDH1A1TSHR
SCHEMBL28100475 1.00 TYR (0.44) TYRPRKCAPPARGALDH1A1TSHR
SCHEMBL27603645 1.00 TYR (0.44) TYRPRKCAPPARGALDH1A1TSHR
SCHEMBL21722461 0.98 TYR (0.42) TYRPRKCAPPARGALDH1A1TSHR
SCHEMBL11474450 0.85 TRPA1 (0.41) PRKCAPPARG
SCHEMBL40326 0.85 TRPA1 (0.41) PRKCAPPARG
SCHEMBL11486535 0.85 TRPA1 (0.41) PRKCAPPARG
SCHEMBL5331987 0.81 ALDH1A1 (0.43) PPARGALDH1A1TSHRCDC25ACDC25B
SCHEMBL22046452 0.80 TSHR (0.44) TYRPRKCAPPARGALDH1A1TSHR
SCHEMBL181913 0.77 ALDH1A1 (0.37) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114929593-A Packaging container for sterilization treatment 株式会社可乐丽 2022-08-19 CN disclosed
CN-113698546-B Method for preparing polyether polycarboxylic acid type high-efficiency water reducing agent from high-boiling residues at bottom of polyethylbenzene tower 中国石油化工股份有限公司 2022-06-14 CN disclosed
CN-110023369-B Process for preparing TDI based polyurethane flexible foams containing organic acid anhydrides and/or organic acid chlorides 科思创德国股份有限公司 2022-03-18 CN disclosed
CN-113698546-A Method for preparing polyether polycarboxylic acid type high-efficiency water reducing agent from high-boiling residues at bottom of polyethylbenzene tower 中国石油化工股份有限公司 2021-11-26 CN disclosed
US-20200079895-A1 METHOD FOR PRODUCING TDI-BASED FLEXIBLE POLYURETHANE FOAMS CONTAINING ORGANIC ACID ANHYDRIDES AND/OR ORGANIC ACID CHLORIDES COVESTRO DEUTSCHLAND AG (DE) 2020-03-12 US disclosed
EP-3548534-A1 METHOD FOR PRODUCING TDI-BASED FLEXIBLE POLYURETHANE FOAMS CONTAINING ORGANIC ACID ANHYDRIDES AND/OR ORGANIC ACID CHLORIDES Covestro Deutschland AG (DE) 2019-10-09 EP disclosed
CN-106366920-A Emulsion used in leather processing process and preparation method thereof 浙江奥王服饰有限公司 2017-02-01 CN disclosed
CN-1693311-A Microcapsule embedded starch and its preparation process LIU DINGGUO (CN) 2005-11-09 CN disclosed
US-6841115-B2 Mold release agent and process for the production of plastic molded parts BAYER AKTIENGESELLSCHAFT (DE) 2005-01-11 US disclosed
US-20040209969-A1 Polyisocyanate polyaddition products ARLT ANDREAS 2004-10-21 US disclosed
US-6800667-B1 CATALYTIC CONDENSATION POLYMERIZATION OF POLYURETHANE FOAM USING ORGANIC AMINE OR METAL COMPOUND IN PRESENCE OF UNREACTED ACID ANHYDRIDE; MATTRESSES, UPHOLSTERY, OR CARPETS BASF CORPORATION 2004-10-05 US disclosed
US-6794421-B2 comprising hydrophobic compounds plus at least one further compound and/or derivative thereof reactive toward primary amines, compound being selected from cyclic sulfonic esters and sulfones and mixtures thereof BASF AKTIENGESELLSCHAFT (DE) 2004-09-21 US disclosed
US-20030192455-A1 Mold release agent and process for the production of plastic molded parts COVESTRO DEUTSCHLAND AG (DE) 2003-10-16 US disclosed
US-20030130366-A1 Polyisocyanate polyaddition products ARLT ANDREAS (DE) 2003-07-10 US disclosed
US-6495611-B1 MATTRESS OR FURNITURE UPHOLSTERY OR CARPET BACKING COMPRISING A FLEXIBLE POLYURETHANE FOAM COMPRISING HYDROPHOBIC COMPOUNDS PLUS AT LEAST ONE CYCLODEXTRIN, RESORCINARENE, CYCLOPHANE AND/OR CYCLOCALIXARENE BASF AKTIENGESELLSCHAFT (DE) 2002-12-17 US disclosed