SCHEMBL27592136

SCHEMBL27592136

CCOC(=O)c1cn(-c2ccc(-c3ccc(N4CC(C(C)C(N)=O)OC4=O)cc3F)cn2)cn1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.43
CYP2C19 P33261 1/20 0.43
MAOA P21397 11/20 0.43
CALML3 P27482 5/20 0.41
MAOB P27338 2/20 0.41
NOTUM Q6P988 1/20 0.40
CYP2C9 P11712 1/20 0.39

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
SCHEMBL27592133 1.00 CYP3A4 (0.43) CYP3A4CYP2C19MAOACALML3MAOB
SCHEMBL27592154 0.88 MAOA (0.44) CYP3A4CYP2C19MAOACALML3MAOB
SCHEMBL6799190 0.88 MAOA (0.46) CYP3A4CYP2C19MAOACALML3MAOB
SCHEMBL27592159 0.88 CYP2C19 (0.46) CYP3A4CYP2C19MAOACALML3MAOB
SCHEMBL27592162 0.88 CYP2C19 (0.46) CYP3A4CYP2C19MAOACALML3MAOB
SCHEMBL6799186 0.85 MAOA (0.55) CYP3A4CYP2C19MAOACALML3MAOB
SCHEMBL28941617 0.82 F10 (0.46) CYP3A4CYP2C19MAOACALML3MAOB
SCHEMBL28941618 0.82 F10 (0.46) CYP3A4CYP2C19MAOACALML3MAOB
SCHEMBL27854872 0.81 MAOA (0.48) CYP3A4CYP2C19MAOACALML3MAOB
SCHEMBL27854874 0.81 MAOA (0.48) CYP3A4CYP2C19MAOACALML3MAOB

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
CN-1433413-A Oxazolidinone derivatives and process for their preparation DONG A PHARM CO LTD (KR) 2003-07-30 CN claimed
CN-1433413-A Oxazolidinone derivatives and process for their preparation DONG A PHARM CO LTD (KR) 2003-07-30 CN disclosed