SCHEMBL6515849

SCHEMBL6515849

CCON=c1sc2cc(N3C[C@H](CN(C(C)=O)C(C)=O)OC3=O)ccc2n1CC

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.42
GRM2 Q14416 4/20 0.36
MAOA P21397 4/20 0.36
F10 P00742 5/20 0.36
ALDH1A1 P00352 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
LMNA P02545 1/20 0.35
PTGS1 P23219 1/20 0.35
CALML3 P27482 1/20 0.35
SDHA P31040 1/20 0.35
PKM P14618 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL6509769 0.92 MAOB (0.41) MAOBGRM2MAOAF10ALDH1A1
SCHEMBL6516105 0.91 MAOB (0.42) MAOBGRM2MAOAF10LMNA
SCHEMBL6511621 0.86 MAOA (0.51) MAOBMAOAF10LMNAPTGS1
SCHEMBL6511624 0.86 MAOA (0.51) MAOBMAOAF10LMNAPTGS1
SCHEMBL6509793 0.86 F10 (0.41) MAOBGRM2MAOAF10CALML3
SCHEMBL6509788 0.86 F10 (0.41) MAOBGRM2MAOAF10CALML3
SCHEMBL6510916 0.84 MAOA (0.43) MAOBMAOAF10LMNAPTGS1
SCHEMBL6510924 0.84 MAOA (0.43) MAOBMAOAF10LMNAPTGS1
SCHEMBL6515852 0.83 MAOA (0.49) MAOBMAOAF10LMNAPTGS1
SCHEMBL6511733 0.82 MAOB (0.39) MAOBGRM2MAOAF10LMNA

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-2005082900-A2 OXAZOLIDINONE AMIDOXIMES AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2005-09-09 WO disclosed