SCHEMBL2479747

SCHEMBL2479747

CC(=O)NC[C@H]1CN(c2ccc(OCC3(O)CCN(OC(=O)OCc4ccccc4)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.49
MAOB P27338 3/20 0.49
PTGS1 P23219 2/20 0.49
SDHA P31040 2/20 0.49
LMNA P02545 1/20 0.49
CALML3 P27482 1/20 0.49
TOP2B Q02880 1/20 0.40

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
SCHEMBL701777 0.91 MAOA (0.51) MAOAMAOBPTGS1SDHALMNA
SCHEMBL2109046 0.89 MAOA (0.49) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5982107 0.85 MAOA (0.56) MAOAMAOBPTGS1SDHALMNA
SCHEMBL702819 0.83 MAOA (0.56) MAOAMAOBPTGS1SDHALMNA
SCHEMBL2108790 0.81 MAOA (0.55) MAOAMAOBPTGS1SDHALMNA
SCHEMBL541127 0.81 CALML3 (0.47) MAOAMAOBCALML3
SCHEMBL541126 0.81 CALML3 (0.47) MAOAMAOBCALML3
SCHEMBL2109814 0.80 MAOA (0.46) MAOAMAOBPTGS1SDHALMNA
SCHEMBL2108909 0.80 MAOA (0.53) MAOAMAOBPTGS1SDHALMNA
SCHEMBL2108908 0.80 MAOA (0.55) 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
EP-2374806-B1 OXAZOLIDINON-QUINOLONE HYBRIDES AND INTERMEDIATES FOR THEIR PREPARATION MORPHOCHEM AG FÜR KOMBINATORISCHE CHEMIE (DE) 2016-11-02 EP disclosed
EP-1660489-B1 INTERMEDIATE PRODUCTS FOR PRODUCING OXAZOLIDINONE-QUINOLONE HYBRIDS MORPHOCHEM AG FÜR KOMBINATORISCHE CHEMIE (DE) 2014-07-02 EP disclosed
EP-2374806-A1 OXAZOLIDINON-QUINOLONe HYBRIDes and intermediates for their preparation Morphochem Aktiengesellschaft Für Kombinatorische Chemie (DE) 2011-10-12 EP disclosed
EP-1660489-A1 INTERMEDIATE PRODUCTS FOR PRODUCING OXAZOLIDINONE-QUINOLONE HYBRIDS Morphochem Aktiengesellschaft Für Kombinatorische Chemie (DE) 2006-05-31 EP disclosed
WO-2005023801-A1 INTERMEDIATE PRODUCTS FOR PRODUCING OXAZOLIDINONE-QUINOLONE HYBRIDS Morphochem Aktiengesellschaft für kombinatorische Chemie (DE) 2005-03-17 WO disclosed