SCHEMBL19725089

SCHEMBL19725089

CC1CN(Cc2ncccn2)C[C@H]1c1nn2c(-c3ccc(F)cc3)ncc2c(=O)[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE9A O76083 20/20 1.00

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
SCHEMBL15148040 1.00 PDE9A (1.00) PDE9A
SCHEMBL15151133 1.00 PDE9A (1.00) PDE9A
SCHEMBL15145103 1.00 PDE9A (1.00) PDE9A
SCHEMBL15142383 0.91 PDE9A (0.82) PDE9A
SCHEMBL15145601 0.90 PDE9A (0.82) PDE9A
SCHEMBL15142135 0.89 PDE9A (0.81) PDE9A
SCHEMBL15279480 0.88 PDE9A (0.79) PDE9A
SCHEMBL878051 0.88 PDE9A (0.79) PDE9A
SCHEMBL18951508 0.86 PDE9A (0.82) PDE9A
SCHEMBL9933035 0.85 PDE9A (0.73) PDE9A

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-3178820-B1 PDE9- INHIBITORS WITH IMIDAZO TRIAZINONE BACKBONE H LUNDBECK AS (DK) 2017-12-20 EP disclosed