SCHEMBL31489183

SCHEMBL31489183

CCC(c1ccc(F)cc1)n1cc(-c2cccc(Br)n2)cn1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 15/20 0.39
JAK1 P23458 15/20 0.39
TYK2 P29597 15/20 0.39
JAK3 P52333 15/20 0.39
CYP17A1 P05093 1/20 0.38
MKNK1 Q9BUB5 1/20 0.33
ITK Q08881 2/20 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
SCHEMBL31489249 1.00 JAK2 (0.39) JAK2JAK1TYK2JAK3CYP17A1
SCHEMBL31489438 0.86 CYP17A1 (0.40) JAK2JAK1TYK2JAK3CYP17A1
SCHEMBL31489819 0.86 CYP17A1 (0.40) JAK2JAK1TYK2JAK3CYP17A1
SCHEMBL31489347 0.84 CREBBP (0.42) CYP17A1
SCHEMBL31489258 0.84 CREBBP (0.42) CYP17A1
SCHEMBL31489575 0.81 GABRA1 (0.32) JAK2JAK1TYK2JAK3MKNK1
SCHEMBL31489349 0.81 GABRA1 (0.32) JAK2JAK1TYK2JAK3MKNK1
SCHEMBL31489590 0.79 CYP17A1 (0.38) JAK2JAK1TYK2JAK3CYP17A1
SCHEMBL31489746 0.79 CYP17A1 (0.38) JAK2JAK1TYK2JAK3CYP17A1
SCHEMBL31489266 0.77 CYP17A1 (0.40) JAK2JAK1TYK2JAK3CYP17A1

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