SCHEMBL14538587

SCHEMBL14538587

Nn1cc(-c2cnc3c(Nc4ccccn4)nccn23)cn1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 7/20 0.44
▸ AURKB Q96GD4 6/20 0.44
▸ TTK P33981 6/20 0.41
▸ FLT3 P36888 3/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ MAPK10 P53779 1/20 0.36
▸ GFER P55789 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ CCNA2 P20248 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ CCNA1 P78396 1/20 0.35
▸ CDK5 Q00535 1/20 0.35
▸ DYRK1A Q13627 1/20 0.35
▸ CDK5R1 Q15078 1/20 0.35
▸ GRM5 P41594 1/20 0.34
▸ KDR P35968 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
SCHEMBL8241637 0.86 AURKA (0.60) AURKAAURKBTTKFLT3CCNA2
SCHEMBL14536959 0.86 TTK (0.54) AURKAAURKBTTK
SCHEMBL14530182 0.81 AURKA (0.53) AURKAAURKBTTKFLT3
SCHEMBL14536759 0.81 AURKA (0.42) AURKAAURKBTTKFLT3
SCHEMBL14537007 0.81 AURKA (0.48) AURKAAURKBTTKCCNA2CDK2
SCHEMBL14537040 0.81 AURKA (0.48) AURKAAURKBTTK
SCHEMBL14537008 0.80 AURKA (0.46) AURKAAURKBTTKFLT3
SCHEMBL13954584 0.80 AURKA (0.53) AURKAAURKBTTKFLT3
SCHEMBL14536794 0.80 AURKA (0.48) AURKAAURKBTTKFLT3
SCHEMBL14536834 0.80 AURKA (0.41) AURKAAURKBTTKMEN1KMT2A

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-2007058942-A2 IMIDAZOPYRAZINES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION (US) 2007-05-24 — — WO disclosed
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