SCHEMBL25463501

SCHEMBL25463501

C=Cc1nc(C(F)F)n(C)n1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 2/20 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
SCHEMBL21888983 0.70 APAF1 (0.34) AOC3
SCHEMBL22143116 0.70 AOC3 (0.50) AOC3
SCHEMBL11172248 0.68
SCHEMBL24940736 0.68 AOC3 (0.31) AOC3
SCHEMBL23264164 0.68 AOC3 (0.31) AOC3
SCHEMBL25521688 0.67 LMNA (0.33) AOC3
SCHEMBL23264478 0.65 AOC3 (0.33) AOC3
SCHEMBL23277314 0.64 AOC3 (0.40) AOC3
SCHEMBL25517559 0.63 HRH4 (0.34) AOC3
SCHEMBL20809888 0.59

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-2023083297-A1 SMALL MOLECULE INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 1 (USP1) AND USES THEREOF INSILICO MEDICINE IP LIMITED (CN) 2023-05-19 WO disclosed