SCHEMBL7590752

SCHEMBL7590752

CC(C)(C)[Si](C)(C)OC(O)Cc1cccc2ccc(OS(=O)(=O)C(F)(F)F)nc12

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 12/20 0.36
MTNR1B P49286 12/20 0.36
PDE4A P27815 3/20 0.34
PDE4C Q08493 3/20 0.34
PDE4D Q08499 3/20 0.34
HSD11B1 P28845 1/20 0.31

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
SCHEMBL7588354 0.80 MTNR1A (0.39) MTNR1AMTNR1BPDE4APDE4CPDE4D
SCHEMBL7210273 0.78 PDE4A (0.34) MTNR1AMTNR1BPDE4APDE4CPDE4D
SCHEMBL3836934 0.76 PDE4A (0.36) MTNR1AMTNR1BPDE4APDE4CPDE4D
SCHEMBL7210224 0.71 PDE4A (0.39) MTNR1AMTNR1BPDE4APDE4CPDE4D
SCHEMBL7210519 0.71 PDE4A (0.33) PDE4APDE4CPDE4D
SCHEMBL17430077 0.71 PDE4A (0.41) MTNR1AMTNR1BPDE4APDE4CPDE4D
SCHEMBL17111682 0.71 IDO1 (0.40)
SCHEMBL7216226 0.69 PDE4A (0.34) PDE4APDE4CPDE4D
SCHEMBL17430074 0.69 MCHR1 (0.53) PDE4APDE4CPDE4D
SCHEMBL22573236 0.69 PDE4A (0.46) PDE4APDE4CPDE4D

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-1240146-A1 2-ARYLQUINOLINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-SYNTHELABO (FR) 2002-09-18 EP disclosed
WO-2001038310-A1 2-ARYLQUINOLINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-SYNTHELABO (FR) 2001-05-31 WO disclosed