SCHEMBL31725713

SCHEMBL31725713

CC(C)(C)OC(=O)N1CC(C)(C)c2ncc(Cc3cc(F)c(F)cc3F)cc21

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
XIAP P98170 19/20 0.42
BIRC2 Q13490 9/20 0.42
DPP4 P27487 1/20 0.38

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
SCHEMBL13733805 0.89 XIAP (0.52) XIAPBIRC2
SCHEMBL13735643 0.88 XIAP (0.51) XIAPBIRC2
SCHEMBL13733977 0.85 XIAP (0.57) XIAPBIRC2
SCHEMBL13733848 0.82 XIAP (0.53) XIAPBIRC2
SCHEMBL25738273 0.82 XIAP (0.47) XIAPBIRC2
SCHEMBL31725927 0.82 XIAP (0.41) XIAPBIRC2
SCHEMBL31725986 0.78 DPP4 (0.37) XIAPDPP4
SCHEMBL31725781 0.78 XIAP (0.39) XIAPBIRC2
SCHEMBL31725835 0.77 NR1H2 (0.39) XIAPBIRC2
SCHEMBL25738272 0.77 NR1H2 (0.39) XIAPBIRC2

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-2025235719-A1 DIMERIC SMAC MIMETICS USEFUL IN HIV THERAPY VIIV HEALTHCARE COMPANY (US) 2025-11-13 WO disclosed