SCHEMBL22400643

SCHEMBL22400643

Cc1nc2c(c(C(C)C(=O)O)nn2C(C)c2ccc(C(F)(F)F)cc2)c(=O)[nH]1

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 20/20 0.62

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
SCHEMBL18282739 0.89 PDE2A (0.63) PDE2A
SCHEMBL18283170 0.88 PDE2A (0.76) PDE2A
SCHEMBL18283082 0.88 PDE2A (0.76) PDE2A
SCHEMBL18283084 0.88 PDE2A (0.76) PDE2A
SCHEMBL18283296 0.87 PDE2A (0.61) PDE2A
SCHEMBL20138458 0.86 PDE2A (0.60) PDE2A
SCHEMBL18283049 0.86 PDE2A (0.60) PDE2A
SCHEMBL18283052 0.86 PDE2A (0.60) PDE2A
SCHEMBL18283159 0.86 PDE2A (0.60) PDE2A
SCHEMBL18281325 0.86 PDE2A (0.58) 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-3302484-B1 6-ALKYL DIHYDROPYRAZOLOPYRIMIDINONE COMPOUNDS AS PDE2 INHIBITORS MERCK SHARP & DOHME (US) 2020-09-16 — — EP claimed
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