SCHEMBL8615913

SCHEMBL8615913

CN(C)C=C(C#N)C=CC#N

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP2C9 P11712 1/20 0.32
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL8989790 0.77
SCHEMBL4478548 0.71
SCHEMBL359551 0.71
SCHEMBL24056630 0.71
SCHEMBL359552 0.71
SCHEMBL9239567 0.69
SCHEMBL8611559 0.69
SCHEMBL22340623 0.68 RAB9A (0.36) RAB9AKMT2ASMN1; SMN2CYP2C9
SCHEMBL5393184 0.68 RAB9A (0.36) RAB9AKMT2ASMN1; SMN2CYP2C9
SCHEMBL5393178 0.68 RAB9A (0.36) RAB9AKMT2ASMN1; SMN2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6321905-A None JP disclosed
EP-0617021-B1 Process for the preparation of 2-halogen-5-cyanopyridines BAYER AG (DE) 1998-06-24 EP disclosed
EP-0607802-B1 Process for the preparation of a mixture of aminomethylenated glutacononitriles BAYER AG (DE) 1998-04-22 EP disclosed
EP-0607804-B1 Process for the preparation of 2-amino-5-aminomethylpyridine BAYER AG (DE) 1996-07-10 EP disclosed
EP-0607803-B1 Process for the preparation of 6-amino-3-pyridinecarbonitriles BAYER AG (DE) 1996-07-10 EP disclosed
US-5480995-A Process for the preparation of 6-amino-nicotinonitriles BAYER AKTIENGESELLSCHAFT (DE) 1996-01-02 US disclosed
US-5459273-A Process for the preparation of 2-halogeno-5-cyano pyridines BAYER AKTIENGESELLSCHAFT (DE) 1995-10-17 US disclosed
JP-H06321905-A PREPARATION OF 2-HALOGENO-5-CYANO-PYRIDINE BAYER AG 1994-11-22 JP disclosed
EP-0617021-A1 Process for the preparation of 2-halogen-5-cyanopyridines BAYER AG (DE) 1994-09-28 EP disclosed
EP-0607804-A1 Process for the preparation of 2-amino-5-aminomethylpyridine BAYER AG (DE) 1994-07-27 EP disclosed
EP-0607802-A1 Process for the preparation of a mixture of aminomethylenated glutacononitriles BAYER AG (DE) 1994-07-27 EP disclosed
EP-0607803-A1 Process for the preparation of 6-amino-3-pyridinecarbonitriles BAYER AG (DE) 1994-07-27 EP disclosed