SCHEMBL8310567

SCHEMBL8310567

O=C1O[C@@H](CO)CN1c1ccc(N2CCN(c3cccnc3)CC2)c(F)c1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CALML3 P27482 5/20 0.60
MAOB P27338 11/20 0.52
MAOA P21397 5/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
LMNA P02545 1/20 0.52
PTGS1 P23219 1/20 0.52
SDHA P31040 1/20 0.52
F10 P00742 1/20 0.49
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48

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
SCHEMBL8308671 0.89 CALML3 (0.61) CALML3MAOBMAOALMNAPTGS1
SCHEMBL28110345 0.89 MAOB (0.58) CALML3MAOBMAOALMNAPTGS1
SCHEMBL28428084 0.89 MAOB (0.58) CALML3MAOBMAOALMNAPTGS1
SCHEMBL8577712 0.87 MAOB (0.71) CALML3MAOBMAOALMNAPTGS1
SCHEMBL8577717 0.87 MAOB (0.71) CALML3MAOBMAOALMNAPTGS1
SCHEMBL8310783 0.85 MAOB (0.52) CALML3MAOBMAOACYP3A4CYP2D6
SCHEMBL8308178 0.85 MAOB (0.52) CALML3MAOBMAOACYP3A4CYP2D6
SCHEMBL28109794 0.84 CALML3 (0.65) CALML3MAOBMAOALMNAPTGS1
SCHEMBL14898018 0.84 CALML3 (0.61) CALML3MAOBMAOALMNAPTGS1
SCHEMBL8447305 0.83 CALML3 (0.57) CALML3MAOBMAOALMNAPTGS1

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
EP-0918770-A1 PYRIDYL-PIPERAZINYL-PHENYL-OXAZOLIDINONE DERIVATIVES AND THEIR USE AS ANTIBACTERIALS AstraZeneca AB (SE) 1999-06-02 EP disclosed
WO-1998001447-A1 PYRIDYL-PIPERAZINYL-PHENYL-OXAZOLIDINONE DERIVATIVES AND THEIR USE AS ANTIBACTERIALS ZENECA LIMITED (GB) 1998-01-15 WO disclosed