SCHEMBL3698286

SCHEMBL3698286

NC(=O)CCC1CN(c2ccc(N3CCOCC3)c(F)c2)C(=O)O1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 13/20 0.68
MAOA P21397 6/20 0.68
PTGS1 P23219 2/20 0.68
SDHA P31040 2/20 0.68
LMNA P02545 1/20 0.68
CALML3 P27482 1/20 0.68
F10 P00742 5/20 0.60

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
SCHEMBL30549098 1.00 MAOB (0.68) MAOBMAOAPTGS1SDHALMNA
SCHEMBL3117922 1.00 MAOB (0.68) MAOBMAOAPTGS1SDHALMNA
SCHEMBL12005810 0.91 MAOB (0.69) MAOBMAOAPTGS1SDHALMNA
SCHEMBL28426963 0.90 MAOB (0.55) MAOBMAOAPTGS1SDHALMNA
SCHEMBL28426964 0.90 MAOB (0.55) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5105138 0.90 MAOB (0.55) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5105135 0.90 MAOB (0.55) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5571723 0.89 F10 (0.60) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6040416 0.88 MAOB (0.62) MAOBMAOAPTGS1SDHALMNA
SCHEMBL20296082 0.87 MAOB (0.61) MAOBMAOAPTGS1SDHALMNA

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-2010026597-A1 ORAL DOSAGE FORMS OF LINEZOLID AND PROCESSES FOR THEIR PREPARATION HETERO RESEARCH FOUNDATION (IN) 2010-03-11 WO disclosed