SCHEMBL31489799

SCHEMBL31489799

Nc1nc2cc(-c3cccc(-c4cnn(Cc5ccccc5)c4)c3)ccn2n1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.54
ADORA2A P29274 1/20 0.51
ADORA1 P30542 1/20 0.51
PIK3CG P48736 7/20 0.50
PIK3CD O00329 6/20 0.50
PIK3CA P42336 1/20 0.50
PIK3CB P42338 1/20 0.50
PI4KA P42356 1/20 0.50
PI4KB Q9UBF8 1/20 0.50
CREBBP Q92793 5/20 0.43
COMT P21964 1/20 0.43
KCNH2 Q12809 1/20 0.39
IKBKE Q14164 1/20 0.39
TBK1 Q9UHD2 1/20 0.39
FYN P06241 1/20 0.39

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
SCHEMBL31489504 0.86 CREBBP (0.44) L3MBTL1ADORA2AADORA1PIK3CGPIK3CD
SCHEMBL31489679 0.80 PIK3CG (0.42) L3MBTL1ADORA2AADORA1PIK3CGPIK3CD
SCHEMBL31480922 0.78 PIK3CG (0.47) PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL22558639 0.77 L3MBTL1 (0.53) L3MBTL1ADORA2AADORA1PIK3CGPIK3CD
SCHEMBL983078 0.77 L3MBTL1 (0.71) L3MBTL1ADORA2AADORA1PIK3CGPIK3CD
SCHEMBL31489765 0.76 L3MBTL1 (0.42) L3MBTL1ADORA2AADORA1PIK3CGPIK3CD
SCHEMBL22558711 0.75 L3MBTL1 (0.53) L3MBTL1ADORA2AADORA1PIK3CGPIK3CD
SCHEMBL3209009 0.74 NUDT1 (0.60) L3MBTL1ADORA2AADORA1PIK3CGPIK3CD
SCHEMBL29786662 0.74 IKBKE (0.51) PIK3CGIKBKETBK1
SCHEMBL20472646 0.74 IKBKE (0.51) PIK3CGIKBKETBK1

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-2025072395-A1 TRIAZOLOPYRIDINYL COMPOUNDS AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2025-04-03 WO disclosed