SCHEMBL14843173

SCHEMBL14843173

Cn1cc(-c2nccs2)nc1CCC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 7/20 0.52
▸ FFAR1 O14842 1/20 0.38
▸ KDM6B O15054 7/20 0.38
▸ HDAC6 Q9UBN7 2/20 0.37
▸ LTA4H P09960 1/20 0.35

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
SCHEMBL14842896 0.74 PDE10A (0.41) PDE10A
SCHEMBL14554710 0.73 PDE10A (0.53) PDE10AHDAC6
SCHEMBL14844871 0.71 PDE10A (0.52) PDE10A
SCHEMBL14843494 0.71 PDE10A (0.57) PDE10A
SCHEMBL14843040 0.69 PDE10A (0.44) PDE10A
SCHEMBL2040808 0.69 PDE10A (1.00) PDE10A
SCHEMBL2038629 0.69 PDE10A (1.00) PDE10A
SCHEMBL14843545 0.68 PDE10A (0.56) PDE10A
SCHEMBL2040867 0.68 PDE10A (1.00) PDE10A
SCHEMBL14842742 0.67 PDE10A (0.50) PDE10A

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
WO-2013050527-A1 QUINAZOLINE DERIVATIVES AS PDE10A ENZYME INHIBITORS H. LUNDBECK A/S (DK) 2013-04-11 — — WO disclosed
WO-2013050527-A1 QUINAZOLINE DERIVATIVES AS PDE10A ENZYME INHIBITORS H. LUNDBECK A/S (DK) 2013-04-11 — — WO disclosed
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