SCHEMBL7258760

SCHEMBL7258760

CC(=O)NC[C@H]1CN(c2ccc(C3=CCN(Cc4ccc([N+](=O)[O-])s4)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.58
MAOB P27338 2/20 0.53
PTGS1 P23219 2/20 0.51
SDHA P31040 2/20 0.51
LMNA P02545 1/20 0.51
CALML3 P27482 1/20 0.51
F10 P00742 7/20 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
SCHEMBL7258764 1.00 MAOA (0.58) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7260860 0.94 MAOA (0.51) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7260863 0.94 MAOA (0.51) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7260834 0.86 MAOA (0.59) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6827071 0.84 MAOA (0.64) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6827066 0.84 MAOA (0.64) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7258761 0.83 MAOA (0.55) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7258765 0.83 MAOA (0.55) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7259844 0.82 MAOA (0.51) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7520655 0.81 MAOA (0.67) MAOAMAOBPTGS1SDHALMNA

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