SCHEMBL31489293

SCHEMBL31489293

CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1nc2cc(-c3cc(Cl)cc(F)c3F)ccn2n1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 4/20 0.33
APP P05067 1/20 0.33
BDKRB1 P46663 1/20 0.33
AKR1C3 P42330 1/20 0.30
AKR1C2 P52895 1/20 0.30
MME P08473 1/20 0.30
KAT7 O95251 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
SCHEMBL31507676 0.85 TDP2 (0.32) TDP2APP
SCHEMBL31489473 0.85 TDP2 (0.32) TDP2APPKAT7
SCHEMBL25440010 0.84 CSNK2A2 (0.32)
SCHEMBL31489466 0.84 AAK1 (0.36) TDP2KAT7
SCHEMBL29498023 0.84 CSNK2A2 (0.32)
SCHEMBL31507885 0.84 TDP2 (0.31) TDP2KAT7
SCHEMBL31489552 0.83 TDP2 (0.34) TDP2APP
SCHEMBL31489812 0.83 TDP2 (0.34) TDP2APP
SCHEMBL31489308 0.83 SSTR4 (0.34)
SCHEMBL31489361 0.82 SSTR4 (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