SCHEMBL7744736

SCHEMBL7744736

COCC(=O)C(=CN(C)C)C(=O)O

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 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
SCHEMBL18726318 1.00 CYP2C9 (0.30) CYP2C9
SCHEMBL12997966 1.00 CYP2C9 (0.30) CYP2C9
SCHEMBL15082131 0.84 GLO1 (0.31) CYP2C9
SCHEMBL262793 0.82 MAPT (0.35) CYP2C9
SCHEMBL19799390 0.82
SCHEMBL262792 0.82 MAPT (0.35) CYP2C9
SCHEMBL2408704 0.82 MAPT (0.35) CYP2C9
SCHEMBL18010748 0.82
SCHEMBL17786995 0.81 ALDH1A1 (0.34)
SCHEMBL17786998 0.81 ALDH1A1 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2549870-B1 PROCESS FOR PREPARING CARBAMOYLPYRIDONE DERIVATIVES AND INTERMEDIATES VIIV HEALTHCARE CO (US) 2017-04-19 EP claimed
WO-2001002385-A1 1-(QUINOLIN-4-YL)-1H-PYRAZOLE DERIVATIVES AND THEIR USE AS FUNGICIDES AVENTIS CROPSCIENCE S.A. (FR) 2001-01-11 WO disclosed