SCHEMBL13367930

SCHEMBL13367930

NC[C@H]1CN(c2ccc(N3CCN(C(=O)C(Cl)Cl)N(C(=O)C(Cl)Cl)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 9/20 0.53
▸ MAOA P21397 3/20 0.53
▸ LMNA P02545 1/20 0.53
▸ PTGS1 P23219 1/20 0.53
▸ CALML3 P27482 1/20 0.53
▸ SDHA P31040 1/20 0.53
▸ F10 P00742 11/20 0.51

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
SCHEMBL13357755 0.87 F10 (0.51) MAOBMAOALMNAPTGS1CALML3
SCHEMBL10151565 0.86 MAOA (0.74) MAOBMAOALMNAPTGS1CALML3
SCHEMBL1498726 0.84 MAOB (0.61) MAOBMAOALMNAPTGS1CALML3
SCHEMBL13367775 0.83 MAOB (0.58) MAOBMAOALMNAPTGS1CALML3
SCHEMBL3523989 0.83 F10 (0.59) MAOBMAOALMNAPTGS1CALML3
SCHEMBL3523994 0.83 F10 (0.59) MAOBMAOALMNAPTGS1CALML3
SCHEMBL78322 0.82 MAOB (0.57) MAOBMAOALMNAPTGS1CALML3
SCHEMBL13404010 0.82 F10 (0.58) MAOBMAOALMNAPTGS1CALML3
SCHEMBL3525075 0.82 F10 (0.58) MAOBMAOALMNAPTGS1CALML3
SCHEMBL13357904 0.82 MAOB (0.53) 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
EP-2181993-A1 Antimicrobial oxazolidinone derivatives Research Foundation Itsuu Laboratory (JP) 2010-05-05 — — EP disclosed
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