SCHEMBL4092726

SCHEMBL4092726

Cc1cccc(C(F)(F)F)c1N1C=C(CC(C)C)[N]C1=O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
P2RX7 Q99572 2/20 0.35
C5AR1 P21730 7/20 0.33
PARP1 P09874 1/20 0.32
AADAT Q8N5Z0 1/20 0.31
CBLB Q13191 4/20 0.31
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL4088979 0.81 L3MBTL1 (0.38) ALDH1A1AADATTDP1L3MBTL1
SCHEMBL76185 0.68 C5AR1 (0.35) ALDH1A1P2RX7C5AR1PARP1
SCHEMBL23841329 0.66 P2RX7 (0.39) ALDH1A1P2RX7TDP1
SCHEMBL27760504 0.65 C5AR1 (0.32) P2RX7C5AR1
SCHEMBL16787389 0.65 ALDH1A1 (0.43) ALDH1A1P2RX7
SCHEMBL4084134 0.64 ALDH1A1 (0.37) ALDH1A1L3MBTL1
SCHEMBL20355248 0.62 P2RX7 (0.43) ALDH1A1P2RX7
SCHEMBL4078586 0.61 L3MBTL1 (0.43) ALDH1A1AADATTDP1L3MBTL1
SCHEMBL10304749 0.61 P2RX7 (0.42) ALDH1A1P2RX7TDP1
SCHEMBL21283351 0.60 GABRA1 (0.52) P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2104665-A2 IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS FOR DIABETES F. Hoffmann-Roche AG (CH) 2009-09-30 EP claimed
WO-2008046758-A2 IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS FOR DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2008-04-24 WO claimed
EP-2104665-A2 IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS FOR DIABETES F. Hoffmann-Roche AG (CH) 2009-09-30 EP disclosed
WO-2008046758-A2 IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS FOR DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2008-04-24 WO disclosed