SCHEMBL1702254

SCHEMBL1702254

COC(=O)C(C)CN=NCC(C)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CYP1A2 P05177 1/20 0.35
FOLH1 Q04609 2/20 0.35
NAALAD2 Q9Y3Q0 2/20 0.35
MME P08473 2/20 0.34
CA14 Q9ULX7 2/20 0.33
ESRRB O95718 1/20 0.33
ALDH1A1 P00352 2/20 0.32
ENPEP Q07075 1/20 0.31
CA12 O43570 1/20 0.31
KMT2A Q03164 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
SCHEMBL36191 0.91 SMN1; SMN2 (0.41) SMN1; SMN2MMECA14ESRRBALDH1A1
SCHEMBL541691 0.84 GABRR1 (0.46) GABRR1CYP1A2FOLH1NAALAD2ENPEP
SCHEMBL3937560 0.82 ALDH1A1 (0.36) GABRR1CYP1A2ALDH1A1KMT2A
SCHEMBL11359811 0.80 TSHR (0.35) SMN1; SMN2CA14ALDH1A1
Nitrous Acid SCHEMBL4311801 0.80 GABRR1 (0.42) GABRR1CYP1A2FOLH1NAALAD2ALDH1A1
SCHEMBL6064332 0.76 TDP1 (0.38) GABRR1CYP1A2
SCHEMBL7316251 0.76 NAALAD2 (0.48) GABRR1SMN1; SMN2CYP1A2FOLH1NAALAD2
SCHEMBL7105090 0.74 SMN1; SMN2 (0.46) GABRR1SMN1; SMN2CYP1A2CA14ESRRB
SCHEMBL6006335 0.74 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9349547 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118344626-A HTPB elastomer based on mercapto Click reaction and preparation method thereof 湖北航天化学技术研究所 2024-07-16 CN claimed
CN-118240141-A Preparation method of hydrophilic polyacrylate microspheres 南京亘闪生物科技有限公司 2024-06-25 CN claimed
CN-114213570-B Acid-sensitive antibacterial coating and preparation method and application thereof 四川大学华西医院 2022-12-02 CN claimed
CN-111234123-B Polyester polymer polyol and preparation method and application thereof 无棣德信化工有限公司 2022-11-04 CN claimed
CN-113174014-B Acrylate comb dispersant, preparation method and application thereof, and organic pigment ink-jet color paste 传美讯电子科技(珠海)有限公司 2022-09-02 CN claimed
CN-112745453-B Fluorine-containing acrylic resin and preparation method and application thereof 西安瑞联新材料股份有限公司 2022-05-03 CN claimed
CN-113956395-A Polymer resin and preparation method thereof, electron beam photoresist and preparation and use methods thereof 江苏汉拓光学材料有限公司 2022-01-21 CN claimed
CN-108970573-B Chemical adsorbent and application and method thereof in purification and co-oxidation method for co-production of tert-butyl alcohol 万华化学集团股份有限公司 2022-01-07 CN claimed
CN-113174014-A Acrylate comb dispersant, preparation method and application thereof, and organic pigment ink-jet color paste 传美讯电子科技(珠海)有限公司 2021-07-27 CN claimed
CN-112932982-A Chain transfer agent-containing curable composition for dental use 株式会社松风 2021-06-11 CN claimed
CN-111234123-A Polyester polymer polyol and preparation method and application thereof 无棣德信化工有限公司 2020-06-05 CN claimed
US-20070265474-A1 Method for Producing 4-(Methylthio)Butane-1,2-Diol SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-11-15 US claimed
EP-1790632-A1 METHOD FOR PRODUCING 4-(METHYLTHIO)BUTANE-1,2-DIOL Sumitomo Chemical Company, Limited (JP) 2007-05-30 EP claimed
US-5856600-A ADDING A CARBONYL COMPOUND TO A NATURAL RUBBER LATEX, AND THEN SUBJECTING THE RESULTING NATURAL RUBBER TO AIR OXIDATION, NARROW MOLECULAR WEIGHT DISTRIBUTION SUMITOMO RUBBER INDUSTRIES, LTD (JP) 1999-01-05 US claimed
US-4723035-A Method for racemization of chrysanthemic acid or its ester SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-02-02 US claimed
JP-63275543-A None JP disclosed
EP-4745188-A1 LATEX COMPOSITION FOR DIP MOLDING, METHOD FOR PREPARING SAME, AND MOLDED ARTICLE LG Chem, Ltd. (KR) 2026-05-20 EP disclosed
US-3935342-A POLYMERIZATION WITH AN UNSATURATED SILYL MONOMER MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1976-01-27 US disclosed
US-3931123-A HYDROPHILIC NITRITE COPOLYMERS CESKOSLOVENSKA AKADAMIE VED (CS) 1976-01-06 US disclosed
US-3931111-A SOLUBLE HYDROPHILIC POLYMERS AND PROCESS FOR PROCESSING THE SAME CESKOSLOVENSKA AKADAMIE VED (CS) 1976-01-06 US disclosed