Sugi Predict

Sugi Predict / Compounds / SCHEMBL2870220

SCHEMBL2870220

SCHEMBL2870220

NC(=O)c1ccccc1C(=O)NC[C@H]1CN(c2ccc(N3CCOCC3)c(F)c2)C(=O)O1

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 9/20 0.72
▸ MAOA P21397 2/20 0.71
▸ LMNA P02545 1/20 0.71
▸ PTGS1 P23219 1/20 0.71
▸ CALML3 P27482 1/20 0.71
▸ SDHA P31040 1/20 0.71
▸ F10 P00742 11/20 0.68

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
SCHEMBL5105363 0.91 F10 (0.60) MAOBMAOALMNAPTGS1CALML3
SCHEMBL16204414 0.91 MAOB (0.77) MAOBMAOALMNAPTGS1CALML3
SCHEMBL14898103 0.89 MAOB (0.73) MAOBMAOALMNAPTGS1CALML3
SCHEMBL15861580 0.89 MAOB (0.73) MAOBMAOALMNAPTGS1CALML3
SCHEMBL15695503 0.88 MAOB (0.76) MAOBMAOALMNAPTGS1CALML3
SCHEMBL15866782 0.87 MAOB (0.67) MAOBMAOALMNAPTGS1CALML3
SCHEMBL14898266 0.86 MAOB (0.69) MAOBMAOALMNAPTGS1CALML3
SCHEMBL4093748 0.85 MAOB (0.73) MAOBMAOALMNAPTGS1CALML3
SCHEMBL15866770 0.85 MAOB (0.68) MAOBMAOALMNAPTGS1CALML3
SCHEMBL4093811 0.85 MAOB (0.68) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010084514-A2 A PROCESS FOR THE PREPARATION OF (5S)-(N)-[[3-[3-FLUORO-4-(4-MORPHOLINYL) PHENYL]-2-OXO-5-OXAZOLIDINYL] METHYL] ACETAMIDE NEULAND LABORATORIES LTD. (IN) 2010-07-29 — — WO disclosed