SCHEMBL513679

SCHEMBL513679

O=[C]NCCCl

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
SCHEMBL1766358 0.81
SCHEMBL5653739 0.79
SCHEMBL5473399 0.78
SCHEMBL514332 0.72
SCHEMBL3583741 0.72
SCHEMBL3425766 0.69 KDM4E (0.30)
SCHEMBL209664 0.67
SCHEMBL1766323 0.67
SCHEMBL1766935 0.67
SCHEMBL207518 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 276 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103705509-A Isoxazoline compositions and their use as antiparasitics INTERVET INT BV 2014-04-09 CN claimed
CN-101778566-A Isoxazoline compositions and their use as antiparasitics INTERVET INT BV 2010-07-14 CN claimed
EP-1189891-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-03-27 EP claimed
US-6362342-B1 BIOSYNTHESIS; DRUG LIBRARIES LION BIOSCIENCE AG (DE) 2002-03-26 US claimed
WO-2001000594-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-01-04 WO claimed
US-4853467-A Nitrogen containing derivatives of epipodophyllotoxin glucosides BRISTOL-MYERS COMPANY (US) 1989-08-01 US claimed
EP-0291957-A2 Nitrogen containing derivatives of epipodophyllotoxin glucosides, a process for preparing them and pharmaceutical compositions Bristol-Myers Squibb Company (US) 1988-11-23 EP claimed
US-4347372-A Benzoxazolyl-glyoxylonitrile-2-oxime ether derivatives CIBA-GEIGY CORPORATION (US) 1982-08-31 US claimed
WO-2024048778-A1 ARYLTETRAHYDROPYRIDINE COMPOUND AND PEST CONTROL AGENT 日産化学株式会社 2024-03-07 WO disclosed
US-20230355590-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE NISSAN CHEMICAL CORPORATION (JP) 2023-11-09 US disclosed
WO-2023210623-A1 HALOALKYL SULFONE ANILIDE COMPOUND AND HERBICIDE CONTAINING SAME 株式会社エス・ディー・エス バイオテック 2023-11-02 WO disclosed
CN-110461887-B Composition for forming cured film, alignment material, and phase difference material 日产化学株式会社 2023-04-04 CN disclosed
CN-107429082-B Composition for forming cured film, alignment material, and phase difference material 日产化学工业株式会社 2023-02-03 CN disclosed
CN-109153857-B Polarizing layer forming composition 日产化学株式会社 2022-04-26 CN disclosed
US-4006163-A POLYESTERS CIBA-GEIGY CORPORATION (US) 1977-02-01 US disclosed
US-RE29119-E 7-Pyridinium methyl carboxyl derivatives of 7-amino-cephalosporanic acid CIBA-GEIGY CORPORATION (US) 1977-01-18 US disclosed
US-3996208-A PENICILLINS CIBA-GEIGY CORPORATION (US) 1976-12-07 US disclosed
US-3989695-A 7β-Amino-cepham-3-ol-4-carboxylic acid compounds CIBA-GEIGY CORPORATION (US) 1976-11-02 US disclosed
US-3932465-A ANTIBIOTIC CIBA-GEIGY CORPORATION (US) 1976-01-13 US disclosed
US-3931268-A Methylhydrazinomethyl-substituted benzoic acid amides HOFFMANN-LA ROCHE INC. (US) 1976-01-06 US disclosed