SCHEMBL48591

SCHEMBL48591

O=C=NC1CC(N=C=O)C1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.55
CYP3A4 P08684 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
SCHEMBL49811 1.00 ALDH1A1 (0.55) ALDH1A1CYP3A4
Hydrogen Sulfide SCHEMBL5133931 0.97 ALDH1A1 (0.52) ALDH1A1CYP3A4
SCHEMBL3955252 0.91 ALDH1A1 (0.55) ALDH1A1CYP3A4
SCHEMBL8622614 0.91 ALDH1A1 (0.55) ALDH1A1CYP3A4
SCHEMBL44159 0.87 ALDH1A1 (0.57) ALDH1A1CYP3A4
SCHEMBL15010774 0.86 ALDH1A1 (0.64) ALDH1A1
SCHEMBL7043819 0.86 ALDH1A1 (0.44) ALDH1A1CYP3A4
SCHEMBL3908196 0.86 APLNR (0.50) ALDH1A1
Cyanate SCHEMBL28236530 0.86 ALDH1A1 (0.44) ALDH1A1
SCHEMBL15010749 0.84 ALDH1A1 (0.48) ALDH1A1CYP3A4

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

Appears in 6661 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3738987-B1 RADIATION CURABLE POLYMERS HENKEL AG & CO KGAA (DE) 2024-07-10 EP claimed
EP-4396258-A1 BIO-BASED RESIN, CURABLE COMPOSITION AND POLYURETHANE BASED THEREON, AND RELATED METHODS Ingevity South Carolina, LLC (US) 2024-07-10 EP claimed
WO-2024137498-A1 THERMOPLASTIC POLYURETHANE BASED COATING COMPOSITION BASF SE (DE) 2024-06-27 WO claimed
WO-2024126747-A1 METHOD OF CURING A POLYTHIOURETHANE BASED SUBSTRATE TOLERANT TO WATER ESSILOR INTERNATIONAL (FR) 2024-06-20 WO claimed
CN-113825622-B Radiation Curable Polymers 汉高股份有限及两合公司 2024-05-24 CN claimed
CN-112824471-B High-weather-resistance transparent coating composition, and preparation method and application thereof 立邦涂料(中国)有限公司 2024-05-03 CN claimed
WO-2024074596-A1 METHOD OF CURING A POLYTHIOURETHANE BASED SUBSTRATE WITH A SALT CATALYST ESSILOR INTERNATIONAL (FR) 2024-04-11 WO claimed
WO-2024058561-A1 COMPOSITION FOR FORMING ECO-FRIENDLY POLYURETHANE FOAM HAVING IMPROVED INSULATION PROPERTIES AND METHOD FOR PREPARING POLYURETHANE FOAM 주식회사 삼양사 2024-03-21 WO claimed
EP-4321550-A2 COMPOSITION FOR FORMING ENVIRONMENTALLY FRIENDLY POLYURETHANE FOAM AND METHOD FOR MANUFACTURING POLYURETHANE FOAM Samyang Corporation (KR) 2024-02-14 EP claimed
US-11897995-B2 Allophanate based dispersing agent BASF SE (DE) 2024-02-13 US claimed
EP-0310704-A2 Reactive thixotropic hot-melt adhesive based on silane Sika AG, vorm. Kaspar Winkler & Co. (CH) 1989-04-12 EP claimed
US-4778845-A One-part adhesive and/or sealing mass which is stable and pumpable at temperatures up to 30 degree C. SIKA AG, VORM. KASPAR WINKLER & CO. (CH) 1988-10-18 US claimed
EP-0255572-A1 One-component storage-stable adhesive and/or sealant pumpable at up to 30 degrees C. Sika AG, vorm. Kaspar Winkler & Co. (CH) 1988-02-10 EP claimed
US-4722946-A MIXTURE OF HIGH AND LOW-MOLECULAR WEIGHT DIOLS POLYMER DYNAMICS (DELAWARE), LTD. (US) 1988-02-02 US claimed
EP-0244608-A1 Reactive hot-melt adhesive Sika AG, vorm. Kaspar Winkler & Co. (CH) 1987-11-11 EP claimed
US-4544743-A Salts of 1,3,5-oxadiazines-2,4,6-triones, 1,3,5-oxadiazines-2,4,6-triones and the preparation thereof SOCIETE CARBOCHIMIQUE (BE) 1985-10-01 US claimed
US-4542177-A Thermoplastic polyester molding composition having an improved impact performance MOBAY CHEMICAL CORPORATION (US) 1985-09-17 US claimed
US-4442833-A Casting or splinting package CUTTER LABORATORIES, INC. (US) 1984-04-17 US claimed
EP-0098005-A2 1,3,5-Oxadiazine-2,4,6-trione salts, 1,3,5-oxadiazine-2,4,6-triones and their preparation SOCIETE CARBOCHIMIQUE en abrégé "CARBOCHIM" (BE) 1984-01-11 EP claimed
US-4322327-A Slow-curing water-curable urethane prepolymer composition MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1982-03-30 US claimed