SCHEMBL7553391

SCHEMBL7553391

NCc1ccc2c(c1)C(=Cc1c[nH]c3ncccc13)C(=O)N2

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 2/20 0.69
PDPK1 O15530 1/20 0.55
CHEK2 O96017 1/20 0.53
CDK1 P06493 1/20 0.53
SRC P12931 1/20 0.53
CSNK2A2 P19784 1/20 0.53
CSNK2B P67870 1/20 0.53
CSNK2A1 P68400 1/20 0.53
NTRK1 P04629 5/20 0.48
SYK P43405 1/20 0.48
KDR P35968 2/20 0.46
RET P07949 2/20 0.46
DAPK3 O43293 1/20 0.46
PRKD3 O94806 1/20 0.46
MAP4K4 O95819 1/20 0.46
ABL1 P00519 1/20 0.46
LCK P06239 1/20 0.46
FYN P06241 1/20 0.46
CSF1R P07333 1/20 0.46
PDGFRB P09619 1/20 0.46

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
SCHEMBL7553386 1.00 CHEK1 (0.69) CHEK1PDPK1CHEK2CDK1SRC
SCHEMBL8467707 0.84 CHEK1 (0.73) CHEK1PDPK1CHEK2CDK1SRC
SCHEMBL8467705 0.84 CHEK1 (0.73) CHEK1PDPK1CHEK2CDK1SRC
SCHEMBL8587308 0.83 NTRK1 (0.68) CHEK1PDPK1NTRK1SYKKDR
SCHEMBL8587311 0.83 NTRK1 (0.68) CHEK1PDPK1NTRK1SYKKDR
SCHEMBL7549757 0.82 NTRK1 (0.71) CHEK1PDPK1CHEK2CDK1SRC
SCHEMBL7549754 0.82 NTRK1 (0.71) CHEK1PDPK1CHEK2CDK1SRC
SCHEMBL857064 0.82 CHEK1 (1.00) CHEK1CHEK2CDK1SRCCSNK2A2
SCHEMBL8464120 0.82 CHEK1 (1.00) CHEK1CHEK2CDK1SRCCSNK2A2
SCHEMBL8464117 0.82 CHEK1 (1.00) CHEK1CHEK2CDK1SRCCSNK2A2

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
EP-0715628-B1 SUBSTITUTED AZAINDOLYLIDENE COMPOUNDS AND PROCESS FOR THEIR PREPARATION PHARMACIA ITALIA SPA (IT) 2002-10-02 EP claimed