SCHEMBL29548173

SCHEMBL29548173

CCCOCc1ncc(-c2ccn3ncc(C4CCC5(CC4)OCCO5)c3c2)cn1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 9/20 0.34

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
SCHEMBL29548729 0.84 CAMKK1 (0.33) PDE10A
SCHEMBL29549126 0.84 PDE10A (0.34) PDE10A
SCHEMBL29548852 0.78 CAMKK1 (0.34) PDE10A
SCHEMBL29548548 0.75 CAMKK1 (0.31) —
SCHEMBL29548522 0.73 ALDH1A1 (0.33) PDE10A
SCHEMBL29548477 0.72 CAMKK1 (0.32) —
SCHEMBL29548569 0.71 GRIN1 (0.50) PDE10A
SCHEMBL29548217 0.67 ALDH1A1 (0.40) PDE10A
SCHEMBL29548244 0.66 ALDH1A1 (0.34) PDE10A
SCHEMBL29548310 0.63 DRD2 (0.39) —

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
WO-2022070288-A1 NITROGEN-CONTAINING BICYCLIC COMPOUND 旭化成ファーマ株式会社 2022-04-07 — — WO disclosed
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