SCHEMBL5513778

SCHEMBL5513778

COc1cc2ncnc(N3CC([SiH3])C(Oc4cnc5ccccc5n4)C3)c2cc1OC

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 15/20 0.69
PDE3A Q14432 8/20 0.69
PDE3B Q13370 7/20 0.69
ACHE P22303 2/20 0.49
BACE1 P56817 2/20 0.49
KIT P10721 1/20 0.48

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
SCHEMBL5994058 0.90 PDE10A (0.72) PDE10APDE3APDE3BACHEBACE1
SCHEMBL4397682 0.89 PDE10A (0.69) PDE10APDE3APDE3BACHEBACE1
SCHEMBL4397080 0.87 PDE10A (0.65) PDE10APDE3APDE3BACHEBACE1
SCHEMBL4411887 0.87 PDE10A (0.67) PDE10APDE3APDE3BACHEBACE1
SCHEMBL4403831 0.87 PDE10A (0.67) PDE10APDE3APDE3BACHEBACE1
SCHEMBL4411881 0.86 PDE10A (0.66) PDE10APDE3APDE3BACHEBACE1
SCHEMBL4401301 0.85 PDE10A (0.68) PDE10APDE3APDE3BACHEBACE1
SCHEMBL5499004 0.85 PDE10A (0.64) PDE10APDE3APDE3BACHEBACE1
SCHEMBL5509404 0.85 PDE10A (0.64) PDE10APDE3APDE3BACHEBACE1
Tetrahydrofuran SCHEMBL4409536 0.85 PDE10A (0.64) PDE10APDE3APDE3BACHEBACE1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1838702-A1 PYRROLIDYL DERIVATIVES OF HETEROAROMATIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS Pfizer Products Inc. (US) 2007-10-03 EP claimed
WO-2006070284-A1 PYRROLIDYL DERIVATIVES OF HETEROAROMATIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS PFIZER PRODUCTS INC. (US) 2006-07-06 WO claimed