SCHEMBL31489231

SCHEMBL31489231

CCC(c1ccc(F)cc1)n1cc(-c2cncc(-c3c(F)cn4nc(N)nc4c3C)n2)cn1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.34
JAK2 O60674 4/20 0.33
JAK1 P23458 4/20 0.33
TYK2 P29597 4/20 0.33
JAK3 P52333 4/20 0.33
PIK3CD O00329 2/20 0.31
PIK3CG P48736 2/20 0.31
PIK3CB P42338 1/20 0.31
PIK3CA P42336 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
SCHEMBL31489614 0.91 JAK2 (0.34) CYP17A1JAK2JAK1TYK2JAK3
SCHEMBL31489785 0.88 CYP17A1 (0.34) CYP17A1JAK2JAK1TYK2JAK3
SCHEMBL31489715 0.87 CYP17A1 (0.32) CYP17A1JAK2JAK1TYK2JAK3
SCHEMBL31489714 0.87 CYP17A1 (0.32) CYP17A1JAK2JAK1TYK2JAK3
SCHEMBL31489766 0.86 PIK3CD (0.33) PIK3CDPIK3CGPIK3CBPIK3CA
SCHEMBL31489294 0.82 CYP17A1 (0.34) CYP17A1JAK2JAK1TYK2JAK3
SCHEMBL31489532 0.81 JAK2 (0.34) CYP17A1JAK2JAK1TYK2JAK3
SCHEMBL31489585 0.80 PIK3CD (0.35) CYP17A1JAK2JAK1TYK2JAK3
SCHEMBL31489654 0.79 PIK3CD (0.33) PIK3CDPIK3CGPIK3CBPIK3CA
SCHEMBL31489341 0.79 JAK2 (0.33) CYP17A1JAK2JAK1TYK2JAK3

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