SCHEMBL52090

SCHEMBL52090

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

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
MAPT P10636 1/20 0.35
PTGS1 P23219 1/20 0.35
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
SLC7A5 Q01650 1/20 0.33
FFAR3 O14843 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33

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
SCHEMBL16632929 0.97 ALDH1A1 (0.33) ALDH1A1MAPTPTGS1TP53TSHR
SCHEMBL23495469 0.97 ALDH1A1 (0.33) ALDH1A1MAPTPTGS1TP53TSHR
SCHEMBL28479123 0.97 ALDH1A1 (0.33) ALDH1A1MAPTPTGS1TP53TSHR
Hydrochloric Acid SCHEMBL27761980 0.97 ALDH1A1 (0.33) ALDH1A1MAPTPTGS1TP53TSHR
Acetic Acid SCHEMBL28000260 0.85 FFAR3 (0.44) ALDH1A1MAPTPTGS1TP53TSHR
SCHEMBL2914550 0.84 ALDH1A1 (0.33) ALDH1A1TSHRFFAR3LCKFYN
SCHEMBL897666 0.84 ALDH1A1 (0.39) ALDH1A1MAPTPTGS1TP53TSHR
SCHEMBL1080373 0.84 TSHR (0.31) TSHRSLC7A5
Pyridine SCHEMBL28362478 0.82 TSHR (0.36) TSHR
SCHEMBL21269846 0.81 ALDH1A1 (0.38) ALDH1A1MAPTPTGS1TP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2223995-B2 CLEANING AGENT FOR REMOVING PAINT LAYERS ON SURFACES, METHOD FOR MANUFACTURING THE AGENT AND CLEANING METHOD INTELLIGENT FLUIDS GMBH (DE) 2024-12-11 EP claimed
US-20240400784-A1 Method for Screening Solvent for Extracting Polyvinyl Chloride, Method for Recycling Waste, Recycled Polyvinyl Chloride, and Composition LG CHEM, LTD. (KR) 2024-12-05 US claimed
US-20240392094-A1 Method for Screening Solvent for Polyvinyl Chloride Extraction, Recycling Method for Waste Material, and Recycled Polyvinyl Chloride and Composition LG CHEM, LTD. (KR) 2024-11-28 US claimed
WO-2024110731-A1 METHOD FOR PURIFYING CHLOROTRIFLUOROETHYLENE BY EXTRACTIVE DISTILLATION ARKEMA FRANCE (FR) 2024-05-30 WO claimed
EP-3652158-B1 METHOD FOR PREPARING PYRIMIDONE COMPOUND SUNSHINE LAKE PHARMA CO LTD (CN) 2024-05-29 EP claimed
EP-3894509-B1 SELF-CURABLE AND LOW TEMPERATURE CURABLE COATING COMPOSITIONS EASTMAN CHEM CO (US) 2024-03-20 EP claimed
EP-3894386-B1 CURABLE COATING COMPOSITIONS EASTMAN CHEM CO (US) 2024-02-21 EP claimed
WO-2023033601-A1 METHOD FOR SCREENING SOLVENT FOR POLYVINYL CHLORIDE EXTRACTION, RECYCLING METHOD FOR WASTE MATERIAL, AND RECYCLED POLYVINYL CHLORIDE AND COMPOSITION 주식회사 엘지화학 2023-03-09 WO claimed
WO-2023033605-A1 METHOD FOR SCREENING SOLVENT FOR EXTRACTING POLYVINYL CHLORIDE, METHOD FOR RECYCLING WASTE, RECYCLED POLYVINYL CHLORIDE, AND COMPOSITION 주식회사 엘지화학 2023-03-09 WO claimed
EP-3055401-B1 USE OF PLURIPHASIC LIQUIDS FOR STRIPPING CROSSLINKED PHOTORESIST INTELLIGENT FLUIDS GMBH (DE) 2022-11-23 EP claimed
EP-0692000-A1 EPOXIDIZED VEGETABLE OIL MODIFICATION OF EPOXY ESTERS SHELL INT RESEARCH (NL) 1996-01-17 EP claimed
US-5441766-A Employing as precursor copper beta-ketoester alone or with Lewis base ligand in presence or absence of hydrogen KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1995-08-15 US claimed
WO-1995009144-A1 NUTRITIVE WATER SOLUBLE GLYCEROL ESTERS OF HYDROXY BUTYRIC ACID EASTMAN CHEMICAL COMPANY (US) 1995-04-06 WO claimed
WO-1995009145-A1 NUTRITIVE GLYCEROL ESTERS OF β-ACYLOXY BUTYRATES EASTMAN CHEMICAL COMPANY (US) 1995-04-06 WO claimed
WO-1994022954-A1 EPOXIDIZED VEGETABLE OIL MODIFICATION OF EPOXY ESTERS SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 1994-10-13 WO claimed
EP-0572463-A1 POLY(ALKYLENE OXIDE) SUBSTITUTED ACETOACETANILIDES. SUN CHEMICAL CORP (US) 1993-12-08 EP claimed
EP-0555589-A1 Vernonia oil modification of epoxy resins SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1993-08-18 EP claimed
US-5227453-A Vernonia oil modification of epoxy resins HI-TEK POLYMERS, INC. (US) 1993-07-13 US claimed
EP-0376859-B1 METHOD FOR FUNCTIONALIZATION OF NUCLEOPHILES EASTMAN KODAK COMPANY (US) 1993-03-31 EP claimed
WO-1992013911-A1 POLY(ALKYLENE OXIDE) SUBSTITUTED ACETOACETANILIDES SUN CHEMICAL CORPORATION (US) 1992-08-20 WO claimed