SCHEMBL30340656

SCHEMBL30340656

COc1cc(N2CCN(C)CC2)ccc1Nc1cc(Nc2cccnc2)ccn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IGF1R P08069 4/20 0.53
▸ CDK2 P24941 3/20 0.53
▸ DYRK1B Q9Y463 3/20 0.53
▸ MAPK10 P53779 1/20 0.53
▸ DYRK3 O43781 1/20 0.50
▸ CLK1 P49759 1/20 0.50
▸ CLK2 P49760 1/20 0.50
▸ CDK5 Q00535 1/20 0.50
▸ DYRK1A Q13627 1/20 0.50
▸ CDK5R1 Q15078 1/20 0.50
▸ DYRK2 Q92630 1/20 0.50
▸ CLK4 Q9HAZ1 1/20 0.50
▸ DYRK4 Q9NR20 1/20 0.50
▸ EGFR P00533 4/20 0.48
▸ IRAK4 Q9NWZ3 1/20 0.48
▸ ALK Q9UM73 5/20 0.47
▸ INSR P06213 3/20 0.47
▸ NPM1 P06748 2/20 0.47
▸ TTK P33981 1/20 0.47
▸ ERBB3 P21860 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
SCHEMBL30340587 0.89 CDK2 (0.55) IGF1RCDK2DYRK1BMAPK10DYRK3
SCHEMBL30340493 0.84 IGF1R (0.54) IGF1RCDK2DYRK1BMAPK10EGFR
SCHEMBL30340548 0.84 MAPK10 (0.51) IGF1RCDK2DYRK1BMAPK10EGFR
SCHEMBL30340705 0.84 MAPK10 (0.49) IGF1RCDK2DYRK1BMAPK10DYRK3
SCHEMBL30340484 0.83 CDK2 (0.56) IGF1RCDK2DYRK1BMAPK10DYRK3
SCHEMBL30340490 0.83 MAPK10 (0.52) IGF1RCDK2DYRK1BMAPK10EGFR
SCHEMBL30340650 0.83 EGFR (0.53) IGF1RCDK2DYRK1BMAPK10EGFR
SCHEMBL30340630 0.83 MAPK10 (0.51) IGF1RCDK2DYRK1BMAPK10DYRK3
SCHEMBL30340504 0.82 MAPK10 (0.51) IGF1RCDK2DYRK1BMAPK10DYRK3
SCHEMBL30340921 0.80 IGF1R (0.54) IGF1RCDK2DYRK1BEGFRALK

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4402127-A1 AMINOPYRIDINES AS ACTIVATORS OF PI3 KINASE UCL Business Ltd (GB) 2024-07-24 — — EP disclosed
WO-2023041905-A1 AMINOPYRIDINES AS ACTIVATORS OF PI3 KINASE UCL BUSINESS LTD (GB) 2023-03-23 — — WO disclosed
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