SCHEMBL7849558

SCHEMBL7849558

CN([C@H]1CCN(c2ccc(N3C[C@H](CN(C(=O)OCC(Cl)(Cl)Cl)c4ccon4)OC3=O)cc2F)C1)[C@@H]1COC(C)(C)O1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.41
MAOA P21397 6/20 0.37
PTGS1 P23219 2/20 0.37
SDHA P31040 2/20 0.37
LMNA P02545 1/20 0.37
CALML3 P27482 1/20 0.37
F10 P00742 8/20 0.36
FPR1 P21462 1/20 0.35
FPR2 P25090 1/20 0.35
KCNH2 Q12809 1/20 0.34

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
SCHEMBL5833531 0.87 F10 (0.41) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5833346 0.84 F10 (0.50) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5834389 0.84 F10 (0.50) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5833205 0.84 F10 (0.43) MAOBMAOAPTGS1SDHALMNA
Hydrochloric Acid SCHEMBL5834140 0.84 F10 (0.49) MAOBMAOAPTGS1SDHALMNA
Hydrochloric Acid SCHEMBL5833874 0.84 F10 (0.49) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5833482 0.83 F10 (0.46) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5833986 0.83 F10 (0.46) MAOBMAOAPTGS1SDHALMNA
SCHEMBL6765964 0.82 MAOB (0.55) MAOBMAOAPTGS1SDHALMNA
SCHEMBL5834190 0.82 F10 (0.53) 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
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