SCHEMBL14466945

SCHEMBL14466945

Nc1ccc(Nc2ncc(-c3ccc(Cl)cc3)o2)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VCP P55072 6/20 0.74
SIRT7 Q9NRC8 1/20 0.71
FLT1 P17948 3/20 0.56
KDR P35968 3/20 0.56
FLT4 P35916 2/20 0.56
PRKAB2 O43741 2/20 0.47
SRC P12931 2/20 0.47
FLT3 P36888 2/20 0.47
PRKAG1 P54619 2/20 0.47
PRKAA2 P54646 2/20 0.47
PRKAA1 Q13131 2/20 0.47
MKNK1 Q9BUB5 2/20 0.47
PRKAG3 Q9UGI9 2/20 0.47
PRKAG2 Q9UGJ0 2/20 0.47
PRKAB1 Q9Y478 2/20 0.47
LCK P06239 1/20 0.47
RPS6KA1 Q15418 1/20 0.47
EPHA2 P29317 1/20 0.45
ROCK1 Q13464 1/20 0.45
PIK3CG P48736 1/20 0.45

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
SCHEMBL14465944 0.85 VCP (1.00) VCPSIRT7FLT1KDRFLT4
SCHEMBL5319550 0.84 VCP (0.72) VCPSIRT7FLT1KDRFLT4
SCHEMBL23540651 0.82 VCP (0.69) VCPSIRT7FLT1KDRFLT4
SCHEMBL5319705 0.82 VCP (0.69) VCPSIRT7FLT1KDRFLT4
SCHEMBL5317574 0.81 VCP (0.68) VCPSIRT7FLT1KDRFLT4
SCHEMBL5322309 0.78 VCP (0.67) VCPSIRT7FLT1KDRFLT4
SCHEMBL5324022 0.78 VCP (0.62) VCPSIRT7FLT1KDRFLT4
SCHEMBL14466048 0.78 SIRT7 (0.61) VCPSIRT7FLT1KDRFLT4
SCHEMBL5319106 0.77 SIRT7 (0.64) VCPSIRT7FLT1KDRFLT4
SCHEMBL22925926 0.77 VCP (0.62) VCPSIRT7FLT1KDRFLT4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007076161-A2 COMPOUNDS WITH THERAPEUTIC ACTIVITY MYRIAD GENETICS, INC (US) 2007-07-05 WO disclosed