SCHEMBL7003014

SCHEMBL7003014

NC(=O)c1cccc2nc(CCl)[nH]c12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK4 O00444 2/20 0.45
MAP4K4 O95819 2/20 0.45
PRKX P51817 2/20 0.45
ROCK1 Q13464 2/20 0.45
CLK4 Q9HAZ1 2/20 0.45
CHEK1 O14757 1/20 0.45
AURKA O14965 1/20 0.45
DAPK3 O43293 1/20 0.45
CSF1R P07333 1/20 0.45
RET P07949 1/20 0.45
FGFR1 P11362 1/20 0.45
PDGFRA P16234 1/20 0.45
LTK P29376 1/20 0.45
KDR P35968 1/20 0.45
MAP2K2 P36507 1/20 0.45
FLT3 P36888 1/20 0.45
CSNK1A1 P48729 1/20 0.45
CDK5 Q00535 1/20 0.45
MAP2K1 Q02750 1/20 0.45
MST1R Q04912 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
SCHEMBL14347043 0.85 DDAH1 (0.46) PLK4MAP4K4PRKXROCK1CLK4
SCHEMBL31363694 0.81 PARP1 (0.44) PLK4MAP4K4PRKXROCK1CLK4
SCHEMBL7002080 0.81 KDM4E (0.48) KDM4EMAPK1HSD17B10LMNARAB9A
SCHEMBL7363561 0.81 PLK4 (0.42) PLK4MAP4K4PRKXROCK1CLK4
SCHEMBL1933250 0.81 PLK4 (0.50) PLK4MAP4K4PRKXROCK1CLK4
SCHEMBL1683119 0.79 PARP1 (0.46) PARP1
SCHEMBL7145208 0.78 BCHE (0.38) KDM4ERECQLHSD17B10RAB9ASMN1; SMN2
SCHEMBL871830 0.76 PARP1 (0.58) PLK4MAP4K4PRKXROCK1CLK4
SCHEMBL7362374 0.76 PARP1 (0.40) PLK4MAP4K4PRKXROCK1CLK4
SCHEMBL6841122 0.76 PARP1 (0.61) PLK4MAP4K4PRKXROCK1CLK4

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-2003106430-A1 BENZIMIDAZOLE INHIBITORS OF POLY(ADP-RIBOSYL) POLYMERASE PFIZER INC. (US) 2003-12-24 WO disclosed