SCHEMBL5813447

SCHEMBL5813447

CCCCN(C[C@@H]1CN(c2ccc(N3CCN(c4ccc([N+](=O)[O-])s4)CC3)c(F)c2)C(=O)O1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.51
MAOA P21397 3/20 0.45
LMNA P02545 1/20 0.44
PTGS1 P23219 1/20 0.44
CALML3 P27482 1/20 0.44
SDHA P31040 1/20 0.44
F10 P00742 11/20 0.44

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
SCHEMBL5813450 1.00 MAOB (0.51) MAOBMAOALMNAPTGS1CALML3
SCHEMBL27614703 0.85 MAOB (0.55) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5822311 0.84 MAOB (0.48) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5822319 0.84 MAOB (0.48) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5808176 0.83 MAOB (0.51) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5813448 0.83 MAOB (0.48) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5807776 0.82 MAOB (0.51) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5822534 0.82 MAOB (0.49) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5807525 0.82 MAOB (0.47) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5807530 0.82 MAOB (0.47) MAOBMAOALMNAPTGS1CALML3

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-2006043121-A1 OXAZOLIDINONE DERIVATIVES AS ANTIMICROBIALS RANBAXY LABORATORIES LIMITED (IN) 2006-04-27 WO disclosed