SCHEMBL30587474

SCHEMBL30587474

[2H]NC(=O)c1cc2c(cn1)COC2

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
XIAP P98170 3/20 0.33
BIRC2 Q13490 3/20 0.33
LCK P06239 1/20 0.30
PRF1 P14222 1/20 0.30
SIRT6 Q8N6T7 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
SCHEMBL19641430 0.88 SIRT6 (0.40) XIAPBIRC2LCKPRF1SIRT6
SCHEMBL30036680 0.88 SIRT6 (0.40) XIAPBIRC2LCKPRF1SIRT6
SCHEMBL16506549 0.79 KDM4E (0.43)
SCHEMBL16516076 0.77 XIAP (0.34) XIAPBIRC2SIRT6
SCHEMBL16521060 0.77 XIAP (0.34) XIAPBIRC2
SCHEMBL18754398 0.73 RIPK1 (0.34) XIAPBIRC2
SCHEMBL3324562 0.70 GABRA1 (0.54)
SCHEMBL29875709 0.68 LCK (0.35) LCKPRF1SIRT6
SCHEMBL16418923 0.66 NOS3 (0.54)
SCHEMBL18248727 0.65 NOS3 (0.52) LCKSIRT6

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
CN-111269221-B Bicyclic lactams and methods of use thereof 豪夫迈·罗氏有限公司 2023-09-26 CN disclosed