SCHEMBL7255332

SCHEMBL7255332

CC(=O)NC[C@H]1CN(c2ccc(C3CCN(Cc4ccc([N+](=O)[O-])o4)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.53
MAOB P27338 3/20 0.53
PTGS1 P23219 2/20 0.53
SDHA P31040 2/20 0.53
LMNA P02545 1/20 0.53
CALML3 P27482 1/20 0.53
F10 P00742 1/20 0.41

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
SCHEMBL7255336 1.00 MAOA (0.53) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7255068 0.93 MAOA (0.46) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7255065 0.93 MAOA (0.46) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7255084 0.93 MAOB (0.44) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7255101 0.93 MAOB (0.44) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7255089 0.93 MAOB (0.44) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7255289 0.92 MAOB (0.44) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7255293 0.91 MAOB (0.42) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7255291 0.91 MAOB (0.42) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7255300 0.91 MAOB (0.42) 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