SCHEMBL31489346

SCHEMBL31489346

COc1c(Br)ccn2nc(N)nc12

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 6/20 0.48
NUDT1 P36639 1/20 0.36
PIK3CD O00329 2/20 0.36
PIK3CG P48736 2/20 0.36
PIK3CB P42338 1/20 0.36
PDGFRB P09619 1/20 0.35
KDR P35968 1/20 0.35
NQO2 P16083 1/20 0.34
HSP90AB1 P08238 7/20 0.34
HSP90AA1 P07900 6/20 0.34
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33

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
Trifluoroacetic Acid SCHEMBL31489607 0.87 JAK2 (0.39) JAK2PIK3CDPIK3CGPDGFRBKDR
SCHEMBL25385595 0.83 JAK2 (0.39) JAK2NUDT1PIK3CDPIK3CGPDGFRB
SCHEMBL23209564 0.81 JAK2 (0.48) JAK2NUDT1PIK3CDPIK3CGPIK3CB
SCHEMBL23761335 0.78 JAK2 (0.41) JAK2NUDT1PIK3CDPIK3CGPIK3CB
SCHEMBL31423910 0.77 JAK2 (0.41) JAK2NUDT1PIK3CDPIK3CGHSP90AB1
SCHEMBL31586363 0.77 JAK2 (0.34) JAK2NUDT1
SCHEMBL31489508 0.76 KDM4E (0.36) NQO2
SCHEMBL31489350 0.75 JAK2 (0.41) JAK2NUDT1PIK3CDPIK3CGPIK3CB
SCHEMBL31480915 0.75 NUDT1 (0.49) JAK2NUDT1PIK3CDPIK3CGPIK3CB
SCHEMBL31489886 0.72 JAK2 (0.40) JAK2NUDT1

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