SCHEMBL7846614

SCHEMBL7846614

O=C(C1C=C(c2c(F)cc(N3C[C@H](CNc4ccon4)OC3=O)cc2F)CCN1)[C@@H](O)CO

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 7/20 0.50
CYP2E1 P05181 1/20 0.44
MAOB P27338 3/20 0.35
CALML3 P27482 2/20 0.35
LMNA P02545 1/20 0.35
PTGS1 P23219 1/20 0.35
SDHA P31040 1/20 0.35
F10 P00742 6/20 0.35

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
SCHEMBL7855134 0.92 MAOA (0.51) MAOACYP2E1MAOBCALML3LMNA
SCHEMBL7843707 0.90 MAOA (0.51) MAOACYP2E1MAOBCALML3LMNA
SCHEMBL7234151 0.85 MAOA (0.45) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL7459673 0.85 MAOA (0.35) MAOAMAOBCALML3
SCHEMBL5834248 0.80 MAOA (0.49) MAOACYP2E1MAOBCALML3LMNA
SCHEMBL7844473 0.79 MAOA (0.46) MAOACYP2E1F10
SCHEMBL7847439 0.79 MAOA (0.56) MAOACYP2E1MAOBCALML3LMNA
SCHEMBL7462586 0.77 MAOA (0.32) MAOAMAOBCALML3LMNAPTGS1
SCHEMBL5834149 0.76 MAOA (0.54) MAOACYP2E1MAOBCALML3LMNA
SCHEMBL5834579 0.75 MAOA (0.51) MAOACYP2E1MAOBCALML3LMNA

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-1121358-A1 HETEROCYCLYLAMINOMETHYLOXAZOLIDINONES AS ANTIBACTERIALS AstraZeneca AB (SE) 2001-08-08 EP disclosed
WO-2000021960-A1 HETEROCYCLYL AMINO METHYLOXA ZOLIDINONES AS ANTIBACTERIALS ASTRAZENECA AB (SE) 2000-04-20 WO disclosed