SCHEMBL6509769

SCHEMBL6509769

CCn1c(=NOC)sc2cc(N3C[C@H](CN(C(C)=O)C(C)=O)OC3=O)ccc21

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.41
GRM2 Q14416 6/20 0.39
ALDH1A1 P00352 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
MAOA P21397 3/20 0.37
F10 P00742 3/20 0.36
LMNA P02545 1/20 0.35
PTGS1 P23219 1/20 0.35
CALML3 P27482 1/20 0.35
SDHA P31040 1/20 0.35
THRB P10828 1/20 0.35
PKM P14618 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL6515849 0.92 MAOB (0.42) MAOBGRM2ALDH1A1NPSR1MAOA
SCHEMBL6511733 0.90 MAOB (0.39) MAOBGRM2MAOAF10LMNA
SCHEMBL6514588 0.86 MAOA (0.52) MAOBMAOAF10LMNAPTGS1
SCHEMBL6514585 0.86 MAOA (0.52) MAOBMAOAF10LMNAPTGS1
SCHEMBL6508377 0.85 F10 (0.41) MAOBGRM2MAOAF10CALML3
SCHEMBL6508380 0.85 F10 (0.41) MAOBGRM2MAOAF10CALML3
SCHEMBL6516105 0.83 MAOB (0.42) MAOBGRM2MAOAF10LMNA
SCHEMBL6511456 0.83 F10 (0.44) MAOBMAOAF10LMNAPTGS1
SCHEMBL6511460 0.83 F10 (0.44) MAOBMAOAF10LMNAPTGS1
SCHEMBL6509772 0.83 MAOA (0.49) MAOBMAOAF10LMNAPTGS1

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