SCHEMBL2461332

SCHEMBL2461332

CCCOc1ccc(F)c2c(=O)c(-c3ccc(OC)cc3)cn(COP(=O)(O)OC(C)(C)C)c12

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.36
MET P08581 7/20 0.32
AXL P30530 4/20 0.32
CLK1 P49759 1/20 0.32
RAB9A P51151 1/20 0.32
MAOB P27338 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
S1PR1 P21453 2/20 0.31
FPR2 P25090 1/20 0.31
PDE4D Q08499 1/20 0.31
KDR P35968 1/20 0.30
CNR1 P21554 1/20 0.30
CNR2 P34972 1/20 0.30
GFER P55789 1/20 0.30

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
SCHEMBL2467694 0.92 CHRM1 (0.35) CHRM1METAXLCLK1RAB9A
SCHEMBL2458317 0.90 CHRM1 (0.39) CHRM1METAXLCLK1RAB9A
SCHEMBL2461831 0.89 CHRM1 (0.39) CHRM1METAXLCLK1RAB9A
SCHEMBL2462952 0.86 CHRM1 (0.37) CHRM1METAXLCLK1RAB9A
SCHEMBL12160648 0.86 CHRM1 (0.35) CHRM1METAXLCLK1RAB9A
SCHEMBL2488754 0.85 CHRM1 (0.37) CHRM1METCLK1RAB9AMAOB
Potassium Ion SCHEMBL2491473 0.85 CHRM1 (0.37) CHRM1METCLK1RAB9AMAOB
SCHEMBL2464053 0.85 CHRM1 (0.37) CHRM1METCLK1RAB9AMAOB
SCHEMBL17970297 0.85 CHRM1 (0.33) CHRM1METAXLCLK1RAB9A
SCHEMBL2464324 0.85 FFAR1 (0.33) METAXL

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-2364298-A1 Quinolone compound and pharmaceutical composition Otsuka Pharmaceutical Co., Ltd. (JP) 2011-09-14 EP disclosed
WO-2010064735-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-06-10 WO disclosed