SCHEMBL7945878

SCHEMBL7945878

COc1cc(N2CC(CNC(C)=O)OC2=O)cc(OC)c1-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.50
MAOB P27338 2/20 0.50
PTGS1 P23219 2/20 0.50
SDHA P31040 2/20 0.50
LMNA P02545 1/20 0.50
CALML3 P27482 1/20 0.50
F10 P00742 3/20 0.47
THRB P10828 1/20 0.45
GRM2 Q14416 2/20 0.44
ABCB11 O95342 1/20 0.43

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
SCHEMBL7945884 0.90 MAOA (0.49) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7949639 0.89 MAOA (0.55) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7938115 0.89 MAOA (0.46) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7938086 0.85 F10 (0.53) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7945894 0.85 MAOA (0.62) MAOAMAOBPTGS1SDHALMNA
SCHEMBL7949620 0.83 MAOA (0.52) MAOAMAOBPTGS1SDHALMNA
SCHEMBL9550276 0.82 MAOA (0.57) MAOAMAOBPTGS1SDHALMNA
SCHEMBL9550299 0.82 MAOA (0.57) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6097066 0.82 F10 (0.64) MAOAMAOBPTGS1SDHALMNA
SCHEMBL27951203 0.82 F10 (0.64) MAOAMAOBPTGS1SDHALMNA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3176626-B2 2001-06-18 JP claimed
EP-0610265-A1 SUBSTITUTED ARYL- AND HETEROARYLPHENYLOXAZOLIDINONES USEFUL AS ANTIBACTERIAL AGENTS. UPJOHN CO (US) 1994-08-17 EP claimed
WO-1993009103-A1 SUBSTITUTED ARYL- AND HETEROARYLPHENYLOXAZOLIDINONES USEFUL AS ANTIBACTERIAL AGENTS THE UPJOHN COMPANY (US) 1993-05-13 WO claimed
EP-0610265-A1 SUBSTITUTED ARYL- AND HETEROARYLPHENYLOXAZOLIDINONES USEFUL AS ANTIBACTERIAL AGENTS. UPJOHN CO (US) 1994-08-17 EP disclosed
WO-1993009103-A1 SUBSTITUTED ARYL- AND HETEROARYLPHENYLOXAZOLIDINONES USEFUL AS ANTIBACTERIAL AGENTS THE UPJOHN COMPANY (US) 1993-05-13 WO disclosed