SCHEMBL7945884

SCHEMBL7945884

COc1cc(N2CC(CNC(C)=O)OC2=O)cc(OC)c1-c1ccncc1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.49
MAOB P27338 2/20 0.48
CALML3 P27482 2/20 0.48
PTGS1 P23219 2/20 0.48
SDHA P31040 2/20 0.48
LMNA P02545 1/20 0.48
ABCB11 O95342 1/20 0.43
F10 P00742 2/20 0.43
THRB P10828 1/20 0.42

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
SCHEMBL7945878 0.90 MAOA (0.50) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL7947020 0.89 MAOA (0.56) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL7938115 0.89 MAOA (0.46) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL7945901 0.86 MAOA (0.50) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL7947008 0.86 MAOA (0.60) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL8489333 0.86 MAOA (0.60) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL7945900 0.83 MAOA (0.50) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL8489164 0.83 MAOA (0.55) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL8489161 0.83 MAOA (0.55) MAOAMAOBCALML3PTGS1SDHA
SCHEMBL7945883 0.81 MAOA (0.54) MAOAMAOBCALML3PTGS1SDHA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3176626-B2 2001-06-18 JP claimed
US-5565571-A BACTERICIDES THE UPJOHN COMPANY (US) 1996-10-15 US 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