SCHEMBL31585

SCHEMBL31585

C=CCC(C(C)=O)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 3/20 0.42
GRIK2 Q13002 3/20 0.42
CYP2C19 P33261 1/20 0.41
CPA1 P15085 1/20 0.41
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35
ALDH1A1 P00352 1/20 0.35
ABCC4 O15439 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31
LMNA P02545 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
SCHEMBL1682020 0.98 GRIK1 (0.41) GRIK1GRIK2CYP2C19CPA1FNTA
SCHEMBL5879474 0.98 GRIK1 (0.41) GRIK1GRIK2CYP2C19CPA1FNTA
SCHEMBL1973010 0.90 GRIK1 (0.40) GRIK1GRIK2CYP2C19CPA1ALDH1A1
Acetoacetic Acid SCHEMBL9493534 0.88 GRIK1 (0.35) GRIK1GRIK2CYP2C19CPA1FNTA
SCHEMBL30979219 0.87 GRIK1 (0.39) GRIK1GRIK2CYP2C19CPA1ALDH1A1
SCHEMBL30979220 0.87 GRIK1 (0.39) GRIK1GRIK2CYP2C19CPA1ALDH1A1
SCHEMBL11227837 0.85 GRIK1 (0.42) GRIK1GRIK2CYP2C19CPA1FNTA
Ethyl Acetate SCHEMBL28822004 0.84 ALDH1A1 (0.50) GRIK1GRIK2CYP2C19CPA1ALDH1A1
SCHEMBL8762424 0.84 GRIK1 (0.33) GRIK1GRIK2CYP2C19CPA1
SCHEMBL7584648 0.84 GRIK1 (0.34) GRIK1GRIK2CYP2C19CPA1ALDH1A1

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 1209 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4225817-B1 AQUEOUS POLYMER COMPOSITION AND METHOD OF PREPARING THEREOF DOW GLOBAL TECHNOLOGIES LLC (US) 2025-07-16 EP claimed
EP-4271719-B1 AQUEOUS COMPOSITION DOW GLOBAL TECHNOLOGIES LLC (US) 2024-11-27 EP claimed
EP-3331697-B1 VOIDED LATEX PARTICLES CONTAINING FUNCTIONALIZED OUTER SHELLS ARKEMA INC (US) 2024-11-20 EP claimed
CN-118688344-A Gas phase detection method for twelve impurities in pentoxifylline starting material (5, 6-dihydro-3-ethoxycarbonyl-2-methyl-4H-pyran) 常州制药厂有限公司 2024-09-24 CN claimed
EP-4430094-A1 AQUEOUS DISPERSION OF POLYMER PARTICLES AND USES THEREOF AS AN ADHESIVE COMPOSITION ARKEMA FRANCE (FR) 2024-09-18 EP claimed
EP-3894475-B1 ASSEMBLY COMPONENTS COMPRISING CURABLE COMPOSITIONS CONTAINING ACETOACETYLATED RESINS EASTMAN CHEM CO (US) 2024-06-19 EP claimed
EP-4367159-A1 POWDER COATING AND CRYSTALLINE DONOR AND/OR ACCEPTOR Allnex Netherlands B.V. (NL) 2024-05-15 EP claimed
EP-4267632-A1 LOW-MOLECULAR-WEIGHT ORGANIC RESIN AND AQUEOUS DISPERSION COMPRISING SAME, FOR A ONE-COMPONENT CROSSLINKABLE COATING COMPOSITION ARKEMA FRANCE (FR) 2023-11-01 EP claimed
WO-2023083873-A1 AQUEOUS DISPERSION OF POLYMER PARTICLES AND USES THEREOF AS AN ADHESIVE COMPOSITION ARKEMA FRANCE (FR) 2023-05-19 WO claimed
EP-4180466-A1 AQUEOUS DISPERSION OF POLYMER PARTICLES AND USES THEREOF AS AN ADHESIVE COMPOSITION ARKEMA FRANCE (FR) 2023-05-17 EP claimed
WO-1991009910-A1 NCO-FREE RESINS USEFUL AS A SUBSTITUTE FOR POLYURETHANES GUERTIN BROS. COATINGS AND SEALANTS, LTD. (CA) 1991-07-11 WO claimed
EP-0424751-A2 Copolymers based on ethylenic unsaturated monomers containing urethane groups, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1991-05-02 EP claimed
EP-0416427-A1 Neutral sizing agent for rough paper masses using cationic polymer dispersions HOECHST AKTIENGESELLSCHAFT (DE) 1991-03-13 EP claimed
WO-1988009323-A1 WATER-SOLUBLE ACTIVE METHYLENES AS FORMALDEHYDE SCAVENGERS WEST POINT PEPPERELL, INC. (US) 1988-12-01 WO claimed
EP-0143881-A2 Process for the preparation of an alkyl ester of L-alpha-aspartyl-L-phenyl-alanine GEMA S.A. (ES) 1985-06-12 EP claimed
US-4442138-A ENCAPSULATION OF ELECTRICAL EQUIPMENT WESTINGHOUSE ELECTRIC CORP. (US) 1984-04-10 US claimed
EP-0048345-B1 PROCESS FOR THE PREPARATION OF AN ALPHA-L-ASPARTYL-L-PHENYLALANINE-ALKYL ESTER CHIMICASA GMBH (CH) 1983-09-21 EP claimed
EP-0048345-A1 Process for the preparation of an alpha-L-aspartyl-L-phenylalanine-alkyl ester CHIMICASA GMBH (CH) 1982-03-31 EP claimed
US-4173588-A FROM 2-METHYL-3-BUTEN-2-OL AND AN ALKYL ACETOACETATE, ORGANOALUMINUM COMPOUND BASF AKTIENGESELLSCHAFT (DE) 1979-11-06 US claimed
US-4167593-A Method of subbing a polyester base CIBA-GEIGY AG (CH) 1979-09-11 US claimed