SCHEMBL6509875

SCHEMBL6509875

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

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.57
MAOB P27338 4/20 0.56
MAOA P21397 2/20 0.56
LMNA P02545 1/20 0.55
PTGS1 P23219 1/20 0.55
CALML3 P27482 1/20 0.55
SDHA P31040 1/20 0.55

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
SCHEMBL6509880 1.00 F10 (0.57) F10MAOBMAOALMNAPTGS1
SCHEMBL5943075 0.93 MAOB (0.57) F10MAOBMAOALMNAPTGS1
SCHEMBL5943077 0.93 MAOB (0.57) F10MAOBMAOALMNAPTGS1
SCHEMBL5799311 0.91 MAOB (0.59) F10MAOBMAOALMNAPTGS1
SCHEMBL5726750 0.90 MAOA (0.70) F10MAOBMAOALMNAPTGS1
SCHEMBL5726745 0.90 MAOA (0.70) F10MAOBMAOALMNAPTGS1
SCHEMBL27614715 0.90 F10 (0.56) F10MAOBMAOALMNAPTGS1
SCHEMBL5733559 0.89 MAOB (0.56) F10MAOBMAOALMNAPTGS1
SCHEMBL6517203 0.89 F10 (0.57) F10MAOBMAOALMNAPTGS1
SCHEMBL6530418 0.89 MAOB (0.58) F10MAOBMAOALMNAPTGS1

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-2005082899-A1 OXAZOLIDINONE DERIVATIVES AS ANTIMICROBIALS RANBAXY LABORATORIES LIMITED (IN) 2005-09-09 WO disclosed