SCHEMBL25759544

SCHEMBL25759544

Cn1nnc(-c2ccc(-c3ccc(N4CC(CN)OC4=O)cc3F)cn2)n1

nearest known ligand 0.87

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOA P21397 12/20 0.87
MAOB P27338 2/20 0.87
CALML3 P27482 5/20 0.52
CYP2C19 P33261 2/20 0.50
CYP2C9 P11712 1/20 0.50
CYP3A4 P08684 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
SCHEMBL24142416 1.00 MAOA (0.87) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL25808764 0.94 MAOA (0.86) MAOAMAOBCALML3CYP2C19CYP2C9
Tedizolid SCHEMBL31385281 0.93 MAOA (1.00) MAOAMAOBCALML3CYP2C19CYP2C9
Tedizolid SCHEMBL29833257 0.93 MAOA (1.00) MAOAMAOBCALML3CYP2C19CYP2C9
Tedizolid SCHEMBL29380875 0.93 MAOA (1.00) MAOAMAOBCALML3CYP2C19CYP2C9
Tedizolid SCHEMBL440398 0.93 MAOA (1.00) MAOAMAOBCALML3CYP2C19CYP2C9
Tedizolid SCHEMBL3807996 0.93 MAOA (1.00) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL12997800 0.92 MAOA (0.89) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL1379662 0.92 MAOA (0.89) MAOAMAOBCALML3CYP2C19CYP2C9
SCHEMBL11982920 0.92 MAOA (0.89) MAOAMAOBCALML3CYP2C19CYP2C9

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-2023122759-A2 OXAZOLIDINONE LIPOSOME COMPOSITIONS AKAGERA MEDICINES, INC. (US) 2023-06-29 WO disclosed