SCHEMBL31489340

SCHEMBL31489340

CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1nc2cc(-c3cncc(Cl)n3)ccn2n1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 2/20 0.34
CYP11B1 P15538 1/20 0.34
PIK3CG P48736 6/20 0.33
PIK3CD O00329 5/20 0.33
PAK4 O96013 1/20 0.33
JAK1 P23458 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
TDP2 O95551 4/20 0.32
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SUV39H2 Q9H5I1 1/20 0.30

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
SCHEMBL31489548 0.87 TDP2 (0.35) PIK3CGPIK3CATDP2HSP90AA1HSP90AB1
SCHEMBL31489814 0.85 PIK3CG (0.38) CYP11B2CYP11B1PIK3CGPIK3CDPIK3CA
SCHEMBL31489228 0.84 TDP2 (0.32) AAK1TDP2HSP90AA1HSP90AB1SUV39H2
SCHEMBL31489598 0.83 EGLN2 (0.32) AAK1HSP90AA1HSP90AB1
SCHEMBL31489435 0.82 PIK3CG (0.33) PIK3CGPIK3CDPAK4JAK1PIK3CA
SCHEMBL31489597 0.82 USP30 (0.36) PIK3CGPIK3CDPAK4JAK1PIK3CA
SCHEMBL31489812 0.81 TDP2 (0.34) PIK3CGPIK3CDPIK3CAPIK3CBAAK1
SCHEMBL31489388 0.80 AAK1 (0.32) CYP11B2CYP11B1AAK1
SCHEMBL31489552 0.79 TDP2 (0.34) TDP2
SCHEMBL31489834 0.78 CSNK2A1 (0.31)

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