SCHEMBL8304658

SCHEMBL8304658

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

nearest known ligand 0.80

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.80
MAOA P21397 3/20 0.80
LMNA P02545 1/20 0.80
PTGS1 P23219 1/20 0.80
CALML3 P27482 1/20 0.80
SDHA P31040 1/20 0.80
F10 P00742 10/20 0.73

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
SCHEMBL8304664 1.00 MAOB (0.80) MAOBMAOALMNAPTGS1CALML3
SCHEMBL14084582 0.91 MAOB (0.82) MAOBMAOALMNAPTGS1CALML3
SCHEMBL14577702 0.91 MAOB (0.79) MAOBMAOALMNAPTGS1CALML3
SCHEMBL7256761 0.91 MAOB (0.79) MAOBMAOALMNAPTGS1CALML3
SCHEMBL14489967 0.91 MAOB (0.79) MAOBMAOALMNAPTGS1CALML3
SCHEMBL27552994 0.91 MAOB (0.79) MAOBMAOALMNAPTGS1CALML3
SCHEMBL7256764 0.91 MAOB (0.79) MAOBMAOALMNAPTGS1CALML3
SCHEMBL7262380 0.91 MAOB (0.79) MAOBMAOALMNAPTGS1CALML3
Hydrochloric Acid SCHEMBL7260980 0.90 MAOB (0.78) MAOBMAOALMNAPTGS1CALML3
SCHEMBL14490007 0.90 MAOB (0.78) 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-0717738-B1 SUBSTITUTED OXAZINE AND THIAZINE OXAZOLIDINONE ANTIMICROBIALS UPJOHN CO (US) 1999-10-20 EP claimed