SCHEMBL7556210

SCHEMBL7556210

O=C1Nc2ccc(C(=O)Nc3ccccc3)cc2/C1=C\c1c[nH]c2ncccc12

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 2/20 0.65
TLK2 Q86UE8 12/20 0.54
CHEK2 O96017 1/20 0.51
CDK1 P06493 1/20 0.51
SRC P12931 1/20 0.51
CSNK2A2 P19784 1/20 0.51
CSNK2B P67870 1/20 0.51
CSNK2A1 P68400 1/20 0.51
JAK3 P52333 1/20 0.49
GSK3B P49841 3/20 0.48
PAK4 O96013 1/20 0.47
PAK1 Q13153 2/20 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
SCHEMBL7556214 1.00 CHEK1 (0.65) CHEK1TLK2CHEK2CDK1SRC
SCHEMBL7554877 0.87 CHEK1 (0.63) CHEK1TLK2CHEK2CDK1SRC
SCHEMBL7554878 0.87 CHEK1 (0.63) CHEK1TLK2CHEK2CDK1SRC
SCHEMBL7557254 0.85 CHEK1 (0.65) CHEK1TLK2CHEK2CDK1SRC
SCHEMBL7556835 0.84 CHEK1 (0.66) CHEK1TLK2CHEK2CDK1SRC
SCHEMBL7556831 0.84 CHEK1 (0.66) CHEK1TLK2CHEK2CDK1SRC
SCHEMBL8530207 0.83 TLK2 (0.53) TLK2JAK3GSK3BPAK4
SCHEMBL7550675 0.83 CHEK1 (0.67) CHEK1TLK2CHEK2CDK1SRC
SCHEMBL7550684 0.83 CHEK1 (0.67) CHEK1TLK2CHEK2CDK1SRC
Hydrochloric Acid SCHEMBL8827979 0.82 CHEK1 (0.66) CHEK1TLK2CHEK2CDK1SRC

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