SCHEMBL5223329

SCHEMBL5223329

NC(=O)c1ccc(-c2ncc[nH]2)cc1N1CCCCC1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 2/20 0.63
ROCK2 O75116 1/20 0.63
MAP4K4 O95819 1/20 0.63
CDK2 P24941 1/20 0.63
GSK3B P49841 1/20 0.63
CLK4 Q9HAZ1 1/20 0.63
IRAK4 Q9NWZ3 1/20 0.63
CDK9 P50750 1/20 0.62
CSNK1A1 P48729 1/20 0.48
TYRO3 Q06418 1/20 0.48
DYRK1B Q9Y463 1/20 0.48
NPC1 O15118 1/20 0.48
HTT P42858 1/20 0.45
PARP1 P09874 1/20 0.45
KDM4E B2RXH2 4/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
ALOX15 P16050 1/20 0.43
GFER P55789 1/20 0.43

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
SCHEMBL23708489 0.89 KDM4E (0.53) CDC7ROCK2MAP4K4CDK2GSK3B
SCHEMBL5224122 0.76 ALDH1A1 (0.53) HTTKDM4EMEN1MAPTKMT2A
SCHEMBL8782056 0.73 CSNK1A1 (0.54) CSNK1A1TYRO3DYRK1BPARP1KDM4E
SCHEMBL3538450 0.71 NPC1 (0.63) CDC7ROCK2MAP4K4CDK2GSK3B
SCHEMBL3085532 0.70 NPC1 (0.61) CDC7ROCK2MAP4K4CDK2GSK3B
SCHEMBL3086459 0.70 NPC1 (0.61) CDC7ROCK2MAP4K4CDK2GSK3B
SCHEMBL2351161 0.70 NISCH (0.53) NPC1HTTKDM4EMEN1MAPT
SCHEMBL22732072 0.69 CSNK1A1 (0.40) CDC7ROCK2MAP4K4CDK2GSK3B
SCHEMBL3715090 0.69 ALDH1A1 (0.59) GSK3BNPC1KDM4EMEN1KMT2A
SCHEMBL4959047 0.68 CDC7 (0.58) CDC7ROCK2MAP4K4CDK2GSK3B

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-1812425-A2 C-FMS KINASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2007-08-01 EP disclosed
WO-2006047479-A2 C-FMS KINASE INHIBITORS JANSSEN PHARMACEUTICA, N.V. (BE) 2006-05-04 WO disclosed