SCHEMBL6533329

SCHEMBL6533329

O=C1OC(Cn2ccnn2)CN1c1ccc(-n2cc(C=NO)nn2)c(F)c1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOA P21397 16/20 0.65
MAOB P27338 1/20 0.65
KCNH2 Q12809 1/20 0.60
CYP3A4 P08684 3/20 0.57
CYP2D6 P10635 1/20 0.57
CYP2C9 P11712 1/20 0.49

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
SCHEMBL5328394 0.82 MAOB (0.47) MAOAMAOBKCNH2CYP3A4
SCHEMBL14541188 0.82 MAOB (0.47) MAOAMAOBKCNH2CYP3A4
SCHEMBL4892870 0.82 MAOA (0.74) MAOACYP3A4CYP2D6CYP2C9
SCHEMBL4892875 0.82 MAOA (0.74) MAOACYP3A4CYP2D6CYP2C9
SCHEMBL6531980 0.81 MAOA (0.61) MAOAMAOBKCNH2CYP3A4CYP2D6
SCHEMBL7840072 0.81 MAOA (0.63) MAOAMAOB
SCHEMBL7840077 0.81 MAOA (0.63) MAOAMAOB
SCHEMBL7840074 0.81 MAOA (0.63) MAOAMAOB
SCHEMBL14480292 0.80 MAOA (0.72) MAOAMAOBKCNH2CYP3A4CYP2D6
SCHEMBL6486990 0.80 MAOA (0.78) MAOAMAOBKCNH2CYP3A4CYP2D6

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