SCHEMBL6530773

SCHEMBL6530773

CCOC(=O)c1cnn(-c2ccc(N3CC(Cn4ccnn4)OC3=O)cc2F)c1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOA P21397 17/20 0.59
MAOB P27338 1/20 0.59
CYP3A4 P08684 3/20 0.55
CYP2D6 P10635 1/20 0.55
KCNH2 Q12809 1/20 0.54
CYP2C9 P11712 1/20 0.51

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
SCHEMBL6530768 1.00 MAOA (0.59) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL6532896 0.88 MAOA (0.64) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL6532898 0.88 MAOA (0.64) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL14540798 0.82 MAOB (0.47) MAOAMAOB
SCHEMBL14541235 0.81 MAOB (0.42) MAOAMAOBKCNH2
SCHEMBL14042563 0.81 MAOA (0.59) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL4174813 0.80 MAOA (0.62) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL14042560 0.80 MAOA (0.57) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL14042567 0.79 MAOA (0.58) MAOAMAOBCYP3A4CYP2D6KCNH2
SCHEMBL5389256 0.79 MAOA (0.77) MAOAMAOBCYP3A4CYP2D6CYP2C9

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