SCHEMBL29090338

SCHEMBL29090338

NC(=O)O[C@H]1CCCC(=C=O)C1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.33
PARP10 Q53GL7 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
SCHEMBL28604391 0.78 ATM (0.36) ATM
SCHEMBL9957309 0.77 THRB (0.41) ATMPARP10
SCHEMBL29090337 0.77 THRB (0.41) ATMPARP10
SCHEMBL28062771 0.75 ATM (0.34) ATMPARP10
SCHEMBL28407513 0.71 THRB (0.37) ATMPARP10
SCHEMBL10067466 0.70 ATM (0.45) ATMPARP10
SCHEMBL113287 0.70
SCHEMBL112091 0.70
SCHEMBL28453661 0.69 ESR2 (0.36) ATMPARP10
SCHEMBL28516952 0.68 ATM (0.37) ATMPARP10

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-116891460-A Indazole derivative or pharmaceutically acceptable salt thereof and application thereof 浙江大学 2023-10-17 CN disclosed