SCHEMBL7868945

SCHEMBL7868945

COC(=O)/C(C)=C/C(Cl)(Cl)Cl

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
MAPT P10636 1/20 0.32
TET2 Q6N021 1/20 0.32
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
HCAR2 Q8TDS4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
GPR35 Q9HC97 1/20 0.30

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
SCHEMBL2417309 1.00 ALDH1A1 (0.39) ALDH1A1MAPTTET2KEAP1NFE2L2
SCHEMBL11032462 0.78 ALDH1A1 (0.40) ALDH1A1TET2KEAP1NFE2L2HCAR2
SCHEMBL7457484 0.78 ALDH1A1 (0.35) ALDH1A1MAPTTET2KEAP1NFE2L2
SCHEMBL8941587 0.76 ALDH1A1 (0.39) ALDH1A1TET2KEAP1NFE2L2HCAR2
SCHEMBL71370 0.76 ALDH1A1 (0.39) ALDH1A1MAPTTET2KEAP1NFE2L2
SCHEMBL3246109 0.76 ALDH1A1 (0.39) ALDH1A1MAPTTET2KEAP1NFE2L2
SCHEMBL11171016 0.73 ALDH1A1 (0.36) ALDH1A1TET2
SCHEMBL11171013 0.73 ALDH1A1 (0.36) ALDH1A1TET2
SCHEMBL7112084 0.73 ALDH1A1 (0.36) ALDH1A1MAPTTET2
SCHEMBL29101734 0.73 ALDH1A1 (0.36) ALDH1A1MAPTTET2GPR35

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-0134079-A2 Process for preparing poly alpha olefins UNIROYAL CHEMICAL COMPANY, Inc. (US) 1985-03-13 EP claimed
US-6310237-B1 REACTIONS OF ALPHA-UNSATURATED CARBOXY ACIDS, ESTERS, AMIDES OR THIOESTERS WITH OF 1.) A LEWIS ACID OR BASE OR 2.) HYDROGEN AND TRANSITION METALS OR THEIR OXIDES, OR 3.) ALKYL ALUMINUMS, ALKYL HYDRIDES, SOLUBLE NICKEL OR PALLADIUM SALTS UNIROYAL CHEMICAL COMPANY, INC. 2001-10-30 US disclosed
EP-1124786-A1 PROCESS FOR THE PREPARATION AND USES OF DERIVATIVES OF ESTERS OF ALPHA-METHYLENE- BETA-HYDROXY ACIDS Uniroyal Chemical Company, Inc. (US) 2001-08-22 EP disclosed
US-6147251-A PREPARATION OF DERIVATIVES OF HALO-BUT-2-ENOIC ACIDS AND ESTERS HIGH IN 2-ENE CONTENT; CATALYST PROMOTERS IN ETHYLENE POLYMERIZATION AND COPOLYMERIZATION UNIROYAL CHEMICAL COMPANY, INC. (US) 2000-11-14 US disclosed
WO-2000027793-A1 PROCESS FOR THE PREPARATION AND USES OF DERIVATIVES OF ESTERS OF ALPHA- METHYLENE- BETA- HYDROXY ACIDS UNIROYAL CHEMICAL COMPANY, INC. (US) 2000-05-18 WO disclosed
US-5527951-A A TRICHLOROBUT-2-ENOATE TO PROMOTE POLYMERIZATION OF ETHYLENE WITH ALPHA-OLEFINS; FORMING EPDM TERPOLYMER USING NEOPENTYL VANADATE CATALYSTS UNIROYAL CHEMICAL COMPANY, INC. (US) 1996-06-18 US disclosed
EP-0134079-B1 PROCESS FOR PREPARING POLY ALPHA OLEFINS UNIROYAL CHEMICAL COMPANY, Inc. (US) 1990-08-29 EP disclosed
EP-0134079-A2 Process for preparing poly alpha olefins UNIROYAL CHEMICAL COMPANY, Inc. (US) 1985-03-13 EP disclosed
EP-0134080-A2 Catalyst for alpha-olefin polymerization UNIROYAL CHEMICAL COMPANY, Inc. (US) 1985-03-13 EP disclosed