SCHEMBL21634816

SCHEMBL21634816

O=C(O)NCC1CN(c2ccc(N3CCC4(CC3)COC4)c(F)c2)C(=O)O1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.65
MAOA P21397 3/20 0.65
PTGS1 P23219 2/20 0.65
SDHA P31040 2/20 0.65
LMNA P02545 1/20 0.65
CALML3 P27482 1/20 0.65
F10 P00742 12/20 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
SCHEMBL21634814 1.00 MAOB (0.65) MAOBMAOAPTGS1SDHALMNA
SCHEMBL21634733 0.92 MAOB (0.78) MAOBMAOAPTGS1SDHALMNA
SCHEMBL21634731 0.92 MAOB (0.78) MAOBMAOAPTGS1SDHALMNA
SCHEMBL18396810 0.91 MAOB (0.62) MAOBMAOAPTGS1SDHALMNA
SCHEMBL18396811 0.91 MAOB (0.62) MAOBMAOAPTGS1SDHALMNA
SCHEMBL31150317 0.90 MAOB (0.65) MAOBMAOAPTGS1SDHALMNA
SCHEMBL3570302 0.88 MAOB (0.75) MAOBMAOAPTGS1SDHALMNA
SCHEMBL3570299 0.88 MAOB (0.75) MAOBMAOAPTGS1SDHALMNA
SCHEMBL21634956 0.88 MAOA (0.48) MAOBMAOAPTGS1SDHALMNA
SCHEMBL21634955 0.88 MAOA (0.48) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020021468-A1 SUBSTITUTED OXAZOLIDINONES FOR THE TREATMENT OF MAMMALIAN INFECTIONS CADILA HEALTHCARE LIMITED (IN) 2020-01-30 WO claimed
WO-2020021468-A1 SUBSTITUTED OXAZOLIDINONES FOR THE TREATMENT OF MAMMALIAN INFECTIONS CADILA HEALTHCARE LIMITED (IN) 2020-01-30 WO disclosed