SCHEMBL6188971

SCHEMBL6188971

N#CCC=C1CCN(c2ccc(N3CC(CNC(=O)C(Cl)Cl)OC3=O)cc2F)CC1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.55
MAOA P21397 3/20 0.55
LMNA P02545 1/20 0.55
PTGS1 P23219 1/20 0.55
CALML3 P27482 1/20 0.55
SDHA P31040 1/20 0.55
F10 P00742 13/20 0.53
KCNH2 Q12809 2/20 0.52

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
SCHEMBL6186237 0.93 MAOB (0.56) MAOBMAOALMNAPTGS1CALML3
SCHEMBL6186240 0.93 MAOB (0.56) MAOBMAOALMNAPTGS1CALML3
SCHEMBL6187414 0.92 MAOB (0.53) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5098136 0.92 KCNH2 (0.61) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5098129 0.92 KCNH2 (0.61) MAOBMAOALMNAPTGS1CALML3
SCHEMBL6186439 0.90 MAOB (0.56) MAOBMAOALMNAPTGS1CALML3
SCHEMBL6186779 0.90 MAOB (0.56) MAOBMAOALMNAPTGS1CALML3
SCHEMBL6184704 0.90 MAOA (0.69) MAOBMAOALMNAPTGS1CALML3
SCHEMBL6184707 0.90 MAOA (0.69) MAOBMAOALMNAPTGS1CALML3
SCHEMBL6185895 0.89 MAOB (0.55) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1565461-A2 ANTIBACTERIAL SUBSTITUTED CYANOMETHYL(ENE)PIPERIDINOPHENYL OXAZOLIDINONES, PROCESS FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Patel, Mahesh V. (IN) 2005-08-24 EP claimed
WO-2004007489-A2 ANTIBACTERIAL SUBSTITUTED CYANOMETHYL (ENE) PIPERIDINOPHENYL OXAZOLIDINONES, PROCESS OR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM WOCKHARDT LIMITED (IN) 2004-01-22 WO claimed
EP-1565461-A2 ANTIBACTERIAL SUBSTITUTED CYANOMETHYL(ENE)PIPERIDINOPHENYL OXAZOLIDINONES, PROCESS FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Patel, Mahesh V. (IN) 2005-08-24 EP disclosed
WO-2004007489-A2 ANTIBACTERIAL SUBSTITUTED CYANOMETHYL (ENE) PIPERIDINOPHENYL OXAZOLIDINONES, PROCESS OR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM WOCKHARDT LIMITED (IN) 2004-01-22 WO disclosed