SCHEMBL13368089

SCHEMBL13368089

CN1CCN(c2ccc(N3C[C@H](CNC=O)OC3=O)cc2F)CCN1C1CC1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 11/20 0.54
▸ MAOA P21397 5/20 0.54
▸ LMNA P02545 1/20 0.54
▸ PTGS1 P23219 1/20 0.54
▸ CALML3 P27482 1/20 0.54
▸ SDHA P31040 1/20 0.54
▸ F10 P00742 7/20 0.47

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
SCHEMBL10151781 0.87 MAOB (0.73) MAOBMAOALMNAPTGS1CALML3
SCHEMBL10151783 0.84 MAOB (0.59) MAOBMAOALMNAPTGS1CALML3
SCHEMBL8304666 0.83 MAOB (0.72) MAOBMAOALMNAPTGS1CALML3
SCHEMBL8304669 0.83 MAOB (0.72) MAOBMAOALMNAPTGS1CALML3
SCHEMBL18408824 0.81 MAOB (0.65) MAOBMAOALMNAPTGS1CALML3
SCHEMBL13655847 0.80 F10 (0.68) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5105655 0.79 KCNH2 (0.67) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5105651 0.79 KCNH2 (0.67) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5112637 0.79 KCNH2 (0.67) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5112632 0.79 KCNH2 (0.67) 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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