SCHEMBL31489343

SCHEMBL31489343

C[C@@H](c1ccc(C#N)cc1)n1cc(-c2cccc(-c3ccn4nc(N)nc4c3)c2F)cn1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 7/20 0.43
RIPK1 Q13546 1/20 0.36
EGLN2 Q96KS0 1/20 0.35
PIK3CG P48736 8/20 0.35
PIK3CD O00329 7/20 0.35
JAK2 O60674 1/20 0.34
TYK2 P29597 1/20 0.34
FEN1 P39748 1/20 0.32
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
KDM1A O60341 1/20 0.31
BRD4 O60885 2/20 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
SCHEMBL31489633 0.90 RIPK1 (0.40) CREBBPRIPK1PIK3CGPIK3CDPAK4
SCHEMBL31489701 0.90 RIPK1 (0.40) CREBBPRIPK1PIK3CGPIK3CDPAK4
SCHEMBL31489221 0.89 CREBBP (0.47) CREBBPRIPK1PIK3CGPIK3CDBRD4
SCHEMBL31489824 0.89 CREBBP (0.47) CREBBPRIPK1PIK3CGPIK3CDBRD4
SCHEMBL31489190 0.88 CREBBP (0.39) CREBBPRIPK1PIK3CGPIK3CDJAK2
SCHEMBL31489426 0.88 CREBBP (0.39) CREBBPRIPK1PIK3CGPIK3CDJAK2
SCHEMBL31489611 0.87 JAK2 (0.39) CREBBPRIPK1PIK3CGPIK3CDJAK2
SCHEMBL31489704 0.87 JAK2 (0.39) CREBBPRIPK1PIK3CGPIK3CDJAK2
SCHEMBL31489674 0.87 RIPK1 (0.42) CREBBPRIPK1PIK3CGPIK3CDPAK4
SCHEMBL31489792 0.87 RIPK1 (0.42) CREBBPRIPK1PIK3CGPIK3CDPAK4

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