SCHEMBL21985666

SCHEMBL21985666

Cc1nc(C(=O)NCc2ccc(S(F)(F)(F)(F)F)cc2)cc(=O)[nH]1

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 20/20 0.69

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
SCHEMBL21985346 0.86 PDE2A (0.67) PDE2A
SCHEMBL21985324 0.83 PDE2A (0.69) PDE2A
SCHEMBL21985333 0.83 PDE2A (0.69) PDE2A
SCHEMBL16868319 0.82 PDE2A (1.00) PDE2A
SCHEMBL21985297 0.81 PDE2A (0.67) PDE2A
SCHEMBL21985467 0.81 PDE2A (0.66) PDE2A
SCHEMBL21985469 0.80 PDE2A (0.70) PDE2A
SCHEMBL16868043 0.78 PDE2A (0.77) PDE2A
SCHEMBL16868080 0.78 PDE2A (1.00) PDE2A
SCHEMBL16867799 0.77 PDE2A (1.00) PDE2A

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-3087060-B1 PYRIMIDONE CARBOXAMIDE COMPOUNDS AS PDE2 INHIBITORS MERCK SHARP & DOHME (US) 2020-05-13 EP disclosed