SCHEMBL4745890

SCHEMBL4745890

C#C/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
SCHEMBL9361504 1.00
SCHEMBL4632025 0.61
SCHEMBL2645697 0.61
SCHEMBL4526279 0.61
SCHEMBL1841946 0.61
SCHEMBL11268482 0.61
SCHEMBL1841948 0.61
SCHEMBL11744140 0.59
SCHEMBL8160246 0.57
SCHEMBL131374 0.56

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1694681-B1 PYRAZOLOPYRIMIDINES BAYER CROPSCIENCE AG (DE) 2008-03-12 EP claimed
EP-1641800-B1 PYRAZOLOPYRIMIDINES BAYER CROPSCIENCE AG (DE) 2008-03-05 EP claimed
EP-1697372-B1 PYRAZOLOPYRIMIDINES BAYER CROPSCIENCE AG (DE) 2007-12-19 EP claimed
EP-1513843-B1 PYRAZOLOPYRIMIDINES AND THE USE THEREOF FOR CONTROLLING HARMFUL ORGANISMS BAYER CROPSCIENCE AG (DE) 2007-07-04 EP claimed
EP-1392693-B1 TRIAZOLOPYRIMIDINES FUNGICIDES BAYER CROPSCIENCE AG (DE) 2007-02-07 EP claimed
EP-1392695-B1 TRIAZOLOPYRIMIDINES BAYER CROPSCIENCE AG (DE) 2006-10-04 EP claimed
EP-0848700-B1 ACYLAMINOSALICYLIC ACID AMIDES AND THEIR USES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2003-07-02 EP claimed
EP-0865423-B1 IMINOACETIC ACID AMIDES AND THEIR USE AS PEST CONTROL AGENTS BAYER CROPSCIENCE AG (DE) 2003-04-23 EP claimed
EP-0975220-B1 USE OF SULFONYLOXADIAZOLONES AS MICROBICIDES BAYER CROPSCIENCE AG (DE) 2003-04-02 EP claimed
EP-0975630-B1 SULFONYLOXADIAZOLONES AND THEIR USE AS MICROBICIDES BAYER AG (DE) 2002-09-18 EP claimed
EP-0628540-B1 2-Oximino-2-phenyl-acetamides BAYER AG (DE) 1999-01-20 EP claimed
EP-0712396-B1 SUBSTITUTED AZADIOXACYCLOALKENES AND THEIR USE AS FUNGICIDES BAYER AG (DE) 1998-11-04 EP claimed
EP-0384211-B1 Substituted acrylic-acid esters BAYER AG (DE) 1994-09-07 EP claimed
EP-0131845-B1 USE OF SUBSTITUTED DIAZOLYLALKYLCARBINOLS IN PLANT PROTECTION FOR THE CONTROL OF FUNGI BAYER AG (DE) 1987-09-02 EP claimed
EP-0085028-B1 N-PHENYLSULFONYL-N'-PYRIMIDINYL AND TRIAZINYL UREAS CIBA-GEIGY AG (CH) 1987-03-25 EP claimed
EP-0111711-B1 HETEROCYCLICALLY SUBSTITUTED HYDROXYALKYL-AZOLYL DERIVATIVES BAYER AG (DE) 1987-03-18 EP claimed
EP-0118069-B1 FUNGICIDES CONTAINING 1,3-DIAZOLYL PROPANOLS BAYER AG (DE) 1986-12-30 EP claimed
EP-0111146-B1 ANTI-MYCOTIC HYDROXYALKYL-AZOLYL DERIVATIVES BAYER AG (DE) 1986-12-30 EP claimed
EP-0120276-B1 SUBSTITUTED DIAZOLYLALKYL OR TRIAZOLYLALKYL CARBINOLS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTIMYCOTIC COMPOUNDS BAYER AG (DE) 1986-10-15 EP claimed
EP-0108995-B1 HYDROXYALKINYL-AZOLYL DERIVATIVES BAYER AG (DE) 1986-05-28 EP claimed