SCHEMBL31489693

SCHEMBL31489693

COc1c(-c2cccc(-c3cnn(C(C)c4ccc(F)cc4)c3)c2F)ccn2nc(N)nc12

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 6/20 0.38
PIK3CD O00329 2/20 0.36
PIK3CA P42336 2/20 0.36
PIK3CG P48736 2/20 0.36
CREBBP Q92793 8/20 0.36
NTRK1 P04629 2/20 0.34
BRD4 O60885 3/20 0.33
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
PFKFB3 Q16875 1/20 0.31

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
SCHEMBL31489485 1.00 JAK2 (0.38) JAK2PIK3CDPIK3CAPIK3CGCREBBP
SCHEMBL31489586 0.91 CREBBP (0.39) JAK2PIK3CDPIK3CAPIK3CGCREBBP
SCHEMBL31489142 0.89 JAK2 (0.36) JAK2PIK3CDPIK3CAPIK3CG
SCHEMBL31489673 0.89 PIK3CD (0.39) JAK2PIK3CDPIK3CAPIK3CGCREBBP
SCHEMBL31489500 0.89 PIK3CD (0.39) JAK2PIK3CDPIK3CAPIK3CGCREBBP
SCHEMBL31489877 0.88 JAK2 (0.36) JAK2PIK3CDPIK3CAPIK3CG
SCHEMBL31489342 0.88 JAK2 (0.36) JAK2PIK3CDPIK3CAPIK3CG
SCHEMBL31489272 0.85 PIK3CD (0.37) JAK2PIK3CDPIK3CAPIK3CGCREBBP
SCHEMBL31489633 0.82 RIPK1 (0.40) PIK3CDPIK3CAPIK3CGCREBBPNTRK1
SCHEMBL31489701 0.82 RIPK1 (0.40) PIK3CDPIK3CAPIK3CGCREBBPNTRK1

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