SCHEMBL20059634

SCHEMBL20059634

Cc1ccc([C@@H]2CC2COc2cc(NCc3cc(C)nn3C)c(=O)n(C)n2)nc1

nearest known ligand 0.84

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 20/20 0.84

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
SCHEMBL16092159 1.00 PDE10A (0.84) PDE10A
SCHEMBL20059543 0.91 PDE10A (1.00) PDE10A
SCHEMBL20059871 0.91 PDE10A (1.00) PDE10A
SCHEMBL16092154 0.91 PDE10A (1.00) PDE10A
SCHEMBL16050184 0.91 PDE10A (1.00) PDE10A
SCHEMBL16092192 0.91 PDE10A (0.82) PDE10A
SCHEMBL20059590 0.91 PDE10A (1.00) PDE10A
SCHEMBL17439721 0.91 PDE10A (1.00) PDE10A
SCHEMBL20059892 0.91 PDE10A (0.82) PDE10A
SCHEMBL16092149 0.89 PDE10A (1.00) PDE10A

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
EP-2968324-B1 SUBSTITUTED PYRIDAZINONE DERIVATIVES AS PDE10 INHIBITORS MERCK SHARP & DOHME (US) 2018-04-18 EP disclosed