SCHEMBL7255019

SCHEMBL7255019

CC(=S)NCC1CN(c2ccc(C3CCN(Cc4ccc([N+](=O)[O-])s4)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.47
MAOB P27338 3/20 0.47
LMNA P02545 1/20 0.46
PTGS1 P23219 1/20 0.46
CALML3 P27482 1/20 0.46
SDHA P31040 1/20 0.46
F10 P00742 14/20 0.43

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
SCHEMBL7255014 1.00 MAOA (0.47) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7258765 0.94 MAOA (0.55) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7258761 0.94 MAOA (0.55) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7255499 0.94 MAOB (0.44) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7255501 0.94 MAOB (0.44) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7255424 0.91 MAOB (0.42) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7255421 0.91 MAOB (0.42) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7255068 0.87 MAOA (0.46) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7255065 0.87 MAOA (0.46) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7259869 0.85 F10 (0.52) MAOAMAOBLMNAPTGS1CALML3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003097640-A1 OXAZOLIDINONE DERIVATIVES AS ANTIBACTERIAL AGENTS ORCHID CHEMICALS & PHARMACEUTICALS LTD. (IN) 2003-11-27 WO claimed
WO-2003097640-A1 OXAZOLIDINONE DERIVATIVES AS ANTIBACTERIAL AGENTS ORCHID CHEMICALS & PHARMACEUTICALS LTD. (IN) 2003-11-27 WO disclosed