SCHEMBL21985339

SCHEMBL21985339

O=C(NCc1ccc(OC(F)(F)F)c(F)c1)c1cc(=O)[nH]c(C2CC2)n1

nearest known ligand 0.67

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 20/20 0.67

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
SCHEMBL21985667 0.86 PDE2A (0.68) PDE2A
SCHEMBL21985683 0.85 PDE2A (0.66) PDE2A
SCHEMBL21985634 0.84 PDE2A (0.60) PDE2A
SCHEMBL21985632 0.81 PDE2A (0.70) PDE2A
SCHEMBL21985992 0.81 PDE2A (0.69) PDE2A
SCHEMBL16867985 0.80 PDE2A (1.00) PDE2A
SCHEMBL18388182 0.80 PDE2A (1.00) PDE2A
SCHEMBL16867988 0.80 PDE2A (1.00) PDE2A
SCHEMBL16868156 0.79 PDE2A (1.00) PDE2A
SCHEMBL19571237 0.79 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