SCHEMBL3021981

SCHEMBL3021981

CC(C#N)O[C]=O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL6574124 0.72
SCHEMBL3762454 0.72 TSHR (0.33)
SCHEMBL3115577 0.71
SCHEMBL96697 0.71
SCHEMBL4683947 0.71
SCHEMBL7638738 0.69
SCHEMBL7629833 0.69
SCHEMBL264243 0.67
SCHEMBL9292 0.67
SCHEMBL9845016 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117105832-A Oxalyl-containing aryl sulfide and preparation method and application thereof 青岛康乔药业集团有限公司 2023-11-24 CN claimed
CN-117062800-A Aryl sulfide and preparation method and application thereof 山东康乔生物科技有限公司 2023-11-14 CN claimed
US-7683200-B2 Compounds for preparing immunological adjuvant EISAI R & D MANAGEMENT CO., LTD. (JP) 2010-03-23 US claimed
WO-2001091558-A1 HERBICIDAL AGENTS BASED ON SUBSTITUTED CARBOXAMIDES BAYER AKTIENGESELLSCHAFT (DE) 2001-12-06 WO claimed
JP-2001518054-A 2001-10-09 JP claimed
EP-1059293-A1 Novel amino chlorothiazole compounds Microcide Pharmaceuticals, Inc. (US) 2000-12-13 EP claimed
EP-0889718-A1 KERATIN FIBRE DYE COMPOSITIONS CONTAINING PYRROLO-AZOLE COMPOUNDS, USE THEREOF AS COUPLERS, AND DYEING METHOD L'OREAL (FR) 1999-01-13 EP claimed
US-5859256-A CHLORINATION; USEFUL AS ANTIBACTERIAL AGENTS AND IN TREATING DISEASES CAUSED BY ORGANISMS WHICH ARE RESISTANT TO BETA-LACTAM ANTIBIOTICS MICROCIDE PHARMACEUTICALS, INC. (US) 1999-01-12 US claimed
EP-0874854-A2 CEPHALOSPORIN ANTIBIOTICS Microcide Pharmaceuticals, Inc. (US) 1998-11-04 EP claimed
EP-0840741-A1 PNA-DNA CHIMERAS AND PNA SYNTHONS FOR THEIR PREPARATION PERSEPTIVE BIOSYSTEMS, INC. (US) 1998-05-13 EP claimed
WO-1997035554-A1 KERATIN FIBRE DYE COMPOSITIONS CONTAINING PYRROLO-AZOLE COMPOUNDS, USE THEREOF AS COUPLERS, AND DYEING METHOD L'OREAL (FR) 1997-10-02 WO claimed
WO-1997013772-A2 CEPHALOSPORIN ANTIBIOTICS MICROCIDE PHARMACEUTICALS, INC. (US) 1997-04-17 WO claimed
WO-1996040709-A1 PNA-DNA CHIMERAS AND PNA SYNTHONS FOR THEIR PREPARATION PERSEPTIVE BIOSYSTEMS, INC. (US) 1996-12-19 WO claimed
EP-0374559-A2 Substituted-2-phenyl-2,2-difluoroethyl thiocarbonates, process for their preparation and their use as herbicides BAYER AG (DE) 1990-06-27 EP claimed
WO-2024135721-A1 METHOD FOR PRODUCING PRODUCTION INTERMEDIATE, PRODUCTION INTERMEDIATE THEREOF, AND METHOD FOR PRODUCING CROSSLINKED ARTIFICIAL NUCLEIC ACID INTERMEDIATE BY USING SAME 田辺三菱製薬株式会社 2024-06-27 WO disclosed
CN-112513062-B Oligonucleotide-containing small cell lung cancer therapeutic agent 国立大学法人大阪大学 2024-05-10 CN disclosed
US-20240148775-A1 OLIGONUCLEOTIDE FOR INDUCING N-EXON SKIPPING DURING REST MRNA PRECURSOR PROCESSING OSAKA UNIVERSITY (JP) 2024-05-09 US disclosed
EP-0074763-A1 A color photographic light-sensitive material KONICA CORPORATION (JP) 1983-03-23 EP disclosed
US-4331676-A 2-PENEM COMPOUNDS UNSUBSTITUTED IN THE 6 POSITION CIBA-GEIGY CORPORATION (US) 1982-05-25 US disclosed
EP-0000644-A2 Lower cycloalkyl substituted-benzene derivatives, the preparation thereof and their pharmaceutical compositions FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1979-02-07 EP disclosed