SCHEMBL30489158

SCHEMBL30489158

O=C1c2cc3ncccc3n2CCN1C1CC1

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 20/20 0.52

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
SCHEMBL18330320 1.00 PDE4A (0.52) PDE4A
SCHEMBL21292094 0.83 PDE4A (0.49) PDE4A
SCHEMBL18330097 0.83 PDE4A (0.49) PDE4A
SCHEMBL29874244 0.83 PDE4A (0.49) PDE4A
SCHEMBL30489172 0.80 PDE4A (0.36) PDE4A
SCHEMBL18322287 0.79 PDE4A (0.45) PDE4A
SCHEMBL18330323 0.78 PDE4A (0.48) PDE4A
SCHEMBL21292082 0.78 PDE4A (0.54) PDE4A
SCHEMBL29612960 0.77 PDE4A (0.45) PDE4A
SCHEMBL18322295 0.77 PDE4A (0.45) PDE4A

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-107787322-B Tricyclic compounds and their use as phosphodiesterase inhibitors 辉瑞大药厂 2023-07-07 CN disclosed