SCHEMBL12086563

SCHEMBL12086563

Fc1cccc(CNc2nnc(-c3c[nH]c4c3=CCCN=4)o2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC7 O00311 13/20 0.60
▸ CCNE1 P24864 13/20 0.60
▸ CDK2 P24941 13/20 0.60
▸ DBF4 Q9UBU7 13/20 0.60
▸ GSK3B P49841 2/20 0.48
▸ QPCT Q16769 2/20 0.37
▸ DYRK1A Q13627 3/20 0.36
▸ CLK1 P49759 2/20 0.36
▸ FLT1 P17948 2/20 0.34
▸ KDR P35968 2/20 0.34
▸ AURKA O14965 1/20 0.34
▸ DAPK3 O43293 1/20 0.34
▸ JAK2 O60674 1/20 0.34
▸ PRKD3 O94806 1/20 0.34
▸ MAP4K4 O95819 1/20 0.34
▸ PAK4 O96013 1/20 0.34
▸ ABL1 P00519 1/20 0.34
▸ LCK P06239 1/20 0.34
▸ CSF1R P07333 1/20 0.34
▸ RET P07949 1/20 0.34

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
SCHEMBL7946423 0.75 CDC7 (1.00) CDC7CCNE1CDK2DBF4GSK3B
SCHEMBL1960827 0.70 CDC7 (0.57) CDC7CCNE1CDK2DBF4GSK3B
SCHEMBL14335342 0.69 CDC7 (0.65) CDC7CCNE1CDK2DBF4ALK
SCHEMBL12506922 0.68 CDC7 (0.56) CDC7CCNE1CDK2DBF4GSK3B
SCHEMBL12550864 0.67 CDC7 (0.53) CDC7CCNE1CDK2DBF4GSK3B
SCHEMBL1551968 0.66 CDC7 (0.52) CDC7CCNE1CDK2DBF4GSK3B
SCHEMBL1958965 0.65 CDC7 (0.53) CDC7CCNE1CDK2DBF4GSK3B
SCHEMBL12507119 0.65 CDC7 (0.78) CDC7CCNE1CDK2DBF4GSK3B
SCHEMBL3491210 0.65 GSK3B (1.00) CDC7CCNE1CDK2DBF4GSK3B
SCHEMBL1557178 0.61 CDC7 (0.74) CDC7CCNE1CDK2DBF4GSK3B

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-2303879-B1 7-AZAINDOLE DERIVATIVES MERCK PATENT GMBH (DE) 2012-09-05 — — EP disclosed
Send feedback