SCHEMBL6510342

SCHEMBL6510342

Nc1ccc(N2CC(Cn3ccnn3)OC2=O)cc1F

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOA P21397 16/20 0.72
MAOB P27338 1/20 0.72
CYP3A4 P08684 3/20 0.68
CYP2D6 P10635 1/20 0.68
KCNH2 Q12809 1/20 0.63
CYP2C9 P11712 1/20 0.56

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
SCHEMBL21999062 1.00 MAOA (0.72) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL3328501 0.90 CYP3A4 (0.79) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL3328495 0.90 CYP3A4 (0.79) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL3328493 0.90 CYP3A4 (0.79) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL11983302 0.89 MAOA (0.73) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL4168836 0.88 MAOA (0.71) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL2849327 0.88 MAOA (0.71) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL1033575 0.88 MAOA (0.71) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL18770272 0.88 MAOA (0.71) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL3195535 0.88 MAOA (0.71) MAOAMAOBCYP3A4CYP2D6KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005042523-A1 A NOVEL OXAZOLIDINONE DERIVATIVE AND MANUFACTURING PROCESS THEREOF IL-DONG PHARM. CO., LTD. (KR) 2005-05-12 WO disclosed