SCHEMBL5134038

SCHEMBL5134038

CN1C(=O)OCCc2cc(N3C[C@@H](C[AsH2])OC3=O)cc(F)c21

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.43
CALML3 P27482 5/20 0.37
MAOB P27338 7/20 0.37
LMNA P02545 1/20 0.37
PTGS1 P23219 1/20 0.37
SDHA P31040 1/20 0.37
SIGMAR1 Q99720 1/20 0.36
GRM2 Q14416 2/20 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
SCHEMBL3826812 0.89 MAOA (0.45) MAOACALML3MAOBLMNAPTGS1
SCHEMBL3832498 0.84 MAOA (0.48) MAOACALML3MAOBLMNAPTGS1
SCHEMBL3829486 0.84 MAOA (0.57) MAOACALML3MAOBLMNAPTGS1
SCHEMBL3830901 0.83 MAOA (0.42) MAOACALML3MAOBLMNAPTGS1
SCHEMBL3826575 0.82 MAOA (0.47) MAOACALML3MAOBLMNAPTGS1
SCHEMBL13607088 0.82 MAOA (0.47) MAOACALML3MAOBLMNAPTGS1
SCHEMBL3833142 0.78 F10 (0.44) MAOACALML3MAOBLMNAPTGS1
SCHEMBL3827610 0.78 F10 (0.44) MAOACALML3MAOBLMNAPTGS1
SCHEMBL3832503 0.77 MAOA (0.42) MAOACALML3MAOBLMNAPTGS1
SCHEMBL3830900 0.76 MAOA (0.41) MAOACALML3MAOBLMNAPTGS1

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-1987025-A1 BENZOXAZINONE AND BENZOXAZEPINONE OXAZOLIDINONES AS ANTIBACTERIAL AGENTS Pfizer Products Incorporated (US) 2008-11-05 EP disclosed
WO-2007093904-A1 BENZOXAZINONE AND BENZOXAZEPINONE OXAZOLIDINONES AS ANTIBACTERIAL AGENTS PFIZER PRODUCTS INC. (US) 2007-08-23 WO disclosed