SCHEMBL31489774

SCHEMBL31489774

C[C@H](c1ccc(F)cc1)n1cc(-c2cccc(-c3ccn4nc(N)nc4c3)c2F)c(F)n1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 4/20 0.41
PIK3CG P48736 12/20 0.36
PIK3CD O00329 9/20 0.36
PAK4 O96013 1/20 0.32
JAK1 P23458 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CB P42338 1/20 0.32
CSNK1A1 P48729 1/20 0.32
AAK1 Q2M2I8 1/20 0.32
PIP4K2C Q8TBX8 1/20 0.32
CSNK1G1 Q9HCP0 1/20 0.32
CYP17A1 P05093 1/20 0.32
TDP2 O95551 1/20 0.32
JAK2 O60674 1/20 0.31
TNIK Q9UKE5 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
SCHEMBL31489421 1.00 RIPK1 (0.41) RIPK1PIK3CGPIK3CDPAK4JAK1
SCHEMBL31489253 0.91 RIPK1 (0.40) RIPK1PIK3CGPIK3CDPAK4JAK1
SCHEMBL31489604 0.91 RIPK1 (0.40) RIPK1PIK3CGPIK3CDPAK4JAK1
SCHEMBL31489556 0.91 RIPK1 (0.40) RIPK1PIK3CGPIK3CDPAK4JAK1
SCHEMBL31489656 0.88 RIPK1 (0.40) RIPK1PIK3CGPIK3CDPAK4JAK1
SCHEMBL31489701 0.88 RIPK1 (0.40) RIPK1PIK3CGPIK3CDPAK4JAK1
SCHEMBL31489633 0.88 RIPK1 (0.40) RIPK1PIK3CGPIK3CDPAK4JAK1
SCHEMBL31489501 0.87 RIPK1 (0.39) RIPK1PIK3CGPIK3CDPAK4JAK1
SCHEMBL31489887 0.85 RIPK1 (0.42) RIPK1PIK3CGPIK3CDPAK4JAK1
SCHEMBL31489651 0.85 RIPK1 (0.41) RIPK1PIK3CGPIK3CDPAK4JAK1

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