SCHEMBL29150549

SCHEMBL29150549

CN(C)Cc1nc(OC(N)=O)ccc1Br

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 3/20 0.31
PARP2 Q9UGN5 1/20 0.31
PARP3 Q9Y6F1 1/20 0.31
NCEH1 Q6PIU2 1/20 0.31
PKM P14618 1/20 0.31

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
SCHEMBL28737030 0.81 NNMT (0.33)
SCHEMBL28876586 0.81 NNMT (0.33)
SCHEMBL29150564 0.80 POLB (0.32) NCEH1PKM
SCHEMBL29202889 0.76 CA2 (0.33)
SCHEMBL28876635 0.76 ACVR1 (0.38)
SCHEMBL29239397 0.76 CNR2 (0.33)
SCHEMBL28931441 0.74 NNMT (0.45)
SCHEMBL23089277 0.73 PARP1 (0.33) PARP1PARP2PARP3
SCHEMBL28876608 0.72 ALDH1A1 (0.35)
SCHEMBL28876491 0.72 NNMT (0.33)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117915912-A HPK1 antagonists and uses thereof 林伯士萨顿公司 2024-04-19 CN disclosed
CN-117377673-A HPK1 antagonists and uses thereof 林伯士萨顿公司 2024-01-09 CN disclosed
CN-117295737-A HPK1 antagonists and uses thereof 林伯士萨顿公司 2023-12-26 CN disclosed