SCHEMBL31489414

SCHEMBL31489414

CC[C@H](c1ccccc1)n1cc(-c2cccc(-c3ccn4nc(N)nc4c3)c2F)cn1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.38
PIK3CG P48736 11/20 0.37
PIK3CD O00329 9/20 0.37
JAK1 P23458 2/20 0.37
JAK2 O60674 1/20 0.37
TYK2 P29597 1/20 0.37
JAK3 P52333 1/20 0.37
CREBBP Q92793 2/20 0.35
ITK Q08881 3/20 0.33
PAK4 O96013 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
CSNK1A1 P48729 1/20 0.33
AAK1 Q2M2I8 1/20 0.33
PIP4K2C Q8TBX8 1/20 0.33
CSNK1G1 Q9HCP0 1/20 0.33
MAPK1 P28482 1/20 0.32
TNIK Q9UKE5 1/20 0.32

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
SCHEMBL31489759 1.00 RIPK1 (0.38) RIPK1PIK3CGPIK3CDJAK1JAK2
SCHEMBL31489650 0.94 RIPK1 (0.37) RIPK1PIK3CGPIK3CDJAK1JAK2
SCHEMBL31489908 0.94 RIPK1 (0.37) RIPK1PIK3CGPIK3CDJAK1JAK2
SCHEMBL31489221 0.88 CREBBP (0.47) RIPK1PIK3CGPIK3CDCREBBP
SCHEMBL31489824 0.88 CREBBP (0.47) RIPK1PIK3CGPIK3CDCREBBP
SCHEMBL31489792 0.81 RIPK1 (0.42) RIPK1PIK3CGPIK3CDJAK1CREBBP
SCHEMBL31489633 0.81 RIPK1 (0.40) RIPK1PIK3CGPIK3CDJAK1CREBBP
SCHEMBL31489701 0.81 RIPK1 (0.40) RIPK1PIK3CGPIK3CDJAK1CREBBP
SCHEMBL31489674 0.81 RIPK1 (0.42) RIPK1PIK3CGPIK3CDJAK1CREBBP
SCHEMBL31489964 0.81 CREBBP (0.43) RIPK1PIK3CGPIK3CDJAK1CREBBP

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