SCHEMBL8569989

SCHEMBL8569989

CO/N=C(/C#N)C(N)=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
SCHEMBL9429335 1.00
SCHEMBL6969365 1.00
SCHEMBL8164357 0.82 MAPT (0.37)
SCHEMBL11329039 0.81 MAPT (0.44)
SCHEMBL11329037 0.81 MAPT (0.44)
SCHEMBL17224961 0.79
SCHEMBL17224962 0.79
SCHEMBL9464218 0.79
SCHEMBL9464668 0.79
SCHEMBL9516454 0.79

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5773624-A Method for preparing 5-amino-1,2,4-thiadiazol acetic acid derivatives KATAYAMA SEIYAKUSYO CO., LTD. (JP) 1998-06-30 US disclosed
EP-0795551-A1 Method for preparing 5-amino-1,2,4-thiadiazol acetic acid derivatives KATAYAMA SEIYAKUSYO CO. Ltd. (JP) 1997-09-17 EP disclosed
EP-0294668-B1 (2-CYANO-2-OXIMINOACETYL)-AMINO ACID DERIVATIVES BAYER AG (DE) 1993-04-07 EP disclosed
EP-0294667-B1 (2-CYANO-2-OXIMINOACETYL)-AMINO ACID DERIVATIVES BAYER AG (DE) 1993-03-17 EP disclosed
EP-0294668-A2 (2-cyano-2-oximinoacetyl)-amino acid derivatives BAYER AG (DE) 1988-12-14 EP disclosed
EP-0294667-A2 (2-cyano-2-oximinoacetyl)-amino acid derivatives BAYER AG (DE) 1988-12-14 EP disclosed
US-4751295-A 7-(2-(5-AMINO-1,2,4-THIADIAZOL-3-YL)-2-OXYIMINOACETAMIDO)-3-(3 -(QUATERNARY AMMONIO)-1-PROPEN-1-YL)-3-CEPHEM-4-CARBOXYLATES BRISTOL-MYERS COMPANY (US) 1988-06-14 US disclosed
EP-0000023-B1 OMEGA-SUBSTITUTED PENTYL UREAS, THEIR PREPARATION AND THEIR USE AS FUNGICIDES BAYER AG (DE) 1980-07-23 EP disclosed
US-4188401-A Combating fungi with 1-(ω-substituted pentyl)-3-(2-cyano-acetyl)-ureas BAYER AKTIENGESELLSCHAFT (DE) 1980-02-12 US disclosed
EP-0000023-A1 Omega-substituted pentyl ureas, their preparation and their use as fungicides BAYER AG (DE) 1978-12-20 EP disclosed
US-4051255-A 2-CYANO-2-HYDROXYIMINOACETAMIDES AS PLANT DISEASE CONTROL AGENTS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-09-27 US disclosed
US-3984568-A Fungicidal cyclopropyl substituted 2-cyanoacetamide derivatives E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-10-05 US disclosed
US-3979518-A PLANTS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-09-07 US disclosed
US-3957847-A FUNGICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-05-18 US disclosed
US-3954992-A FUNGICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-05-04 US disclosed