SCHEMBL2097542

SCHEMBL2097542

C=CCC(=C)C(N)(CC=C)OC(=O)C=C

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL4871064 0.80 ALDH1A1 (0.31) ALDH1A1
SCHEMBL11089429 0.77
Ammonia Solution, Strong SCHEMBL8525617 0.77 ALDH1A1 (0.32) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL10912883 0.71 ALDH1A1 (0.38) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL11500776 0.71 TSHR (0.35) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL29134499 0.69 ALDH1A1 (0.39) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL3264759 0.67 TSHR (0.32) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL10897402 0.67 ALDH1A1 (0.33) ALDH1A1CYP3A4MAPK1
SCHEMBL2050206 0.66
SCHEMBL3666505 0.66 TSHR (0.38) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6391292-B1 COMPOSITIONS FOR FORM RETENTION OF AND/OR FIXING HAIRSTYLE WHICH PROVIDE HAIR WITH GOOD COSMETIC PROPERTIES, IN PARTICULAR GOOD DISENTANGLING, SOFTNESS AND PLEASANT APPEARANCE, IN ADDITION TO FIXING WHICH LASTS L'ORéAL S.A. (FR) 2002-05-21 US claimed
EP-0322234-B1 Process for the preparation of cationic polymers EXXON CHEMICAL PATENTS INC (US) 1993-12-29 EP claimed
EP-0048128-B2 COATING COMPOSITIONS INTERNATIONAL PAINT Public Limited Company (GB) 1987-12-02 EP claimed
EP-0048128-B1 COATING COMPOSITIONS INTERNATIONAL PAINT Public Limited Company (GB) 1984-01-18 EP claimed
EP-0048128-A1 Coating compositions INTERNATIONAL PAINT Public Limited Company (GB) 1982-03-24 EP claimed
US-9404221-B2 Compositions that include hydrophobizing agents and stabilizers and methods for making and using same GEORGIA-PACIFIC CHEMICALS LLC (US) 2016-08-02 US disclosed
EP-2948515-A1 COMPOSITIONS THAT INCLUDE HYDROPHOBIZING AGENTS AND STABILIZERS AND METHODS FOR MAKING AND USING SAME Georgia-Pacific Chemicals LLC (US) 2015-12-02 EP disclosed
US-20140275351-A1 HYDROPHOBIZING AGENTS FOR USE IN MAKING COMPOSITE LIGNOCELLULOSE PRODUCTS GEORGIA-PACIFIC CHEMICALS LLC (US) 2014-09-18 US disclosed
WO-2014116377-A1 COMPOSITIONS THAT INCLUDE HYDROPHOBIZING AGENTS AND STABILIZERS AND METHODS FOR MAKING AND USING SAME GEORGIA-PACIFIC CHEMICALS LLC (US) 2014-07-31 WO disclosed
US-20140202647-A1 COMPOSITIONS THAT INCLUDE HYDROPHOBIZING AGENTS AND STABILIZERS AND METHODS FOR MAKING AND USING SAME GEORGIA-PACIFIC CHEMICALS LLC (US) 2014-07-24 US disclosed
US-8163133-B2 comprises cellulose reactive sizing agent (ketene dimers and multimers; acrylic acid-styrene copolymers), cellulose non-reactive sizing agent, and emulsifier (oxyalkylene phosphate and sulfate esters); for internal sizing or surface sizing in the production of paper AKZO NOBEL N.V. (NL) 2012-04-24 US disclosed
US-7674785-B2 Topical anti-microbial compositions THE PROCTER & GAMBLE COMPANY (US) 2010-03-09 US disclosed
EP-0304816-A1 Basecoat/clearcoat method of coating utilizing an anhydride additive in the thermoplastic polymer-containing basecoat for improved repairability PPG INDUSTRIES, INC. (US) 1989-03-01 EP disclosed
EP-0304817-A1 Non-yellowing coating composition based on a hydroxy component and an anhydride component and utilization in a process of coating PPG INDUSTRIES, INC. (US) 1989-03-01 EP disclosed
US-4798746-A Basecoat/clearcoat method of coating utilizing an anhydride additive in the thermoplastic polymer-containing basecoat for improved repairability PPG INDUSTRIES, INC. (US) 1989-01-17 US disclosed
US-4798745-A CROSSLINKING A MALEIC ANHYDRIDE COPOLYMER PPG INDUSTRIES, INC. (US) 1989-01-17 US disclosed
EP-0048128-B2 COATING COMPOSITIONS INTERNATIONAL PAINT Public Limited Company (GB) 1987-12-02 EP disclosed
US-4452948-A Coating composition comprising a hydroxy component, an anhydride component and a catalyst THE INTERNATIONAL PAINT COMPANY LIMITED (GB) 1984-06-05 US disclosed
EP-0048128-B1 COATING COMPOSITIONS INTERNATIONAL PAINT Public Limited Company (GB) 1984-01-18 EP disclosed
EP-0048128-A1 Coating compositions INTERNATIONAL PAINT Public Limited Company (GB) 1982-03-24 EP disclosed