SCHEMBL2490651

SCHEMBL2490651

O=C(c1ccc(Oc2ncccc2[C@@H]2CCCO2)cc1)c1nc2ccccc2[nH]1.O=C(c1ccc(Oc2ncccc2[C@H]2CCCO2)cc1)c1nc2ccccc2[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 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
SCHEMBL2489087 1.00 PDE10A (1.00) PDE10A
SCHEMBL2488890 1.00 PDE10A (1.00) PDE10A
SCHEMBL2488889 1.00 PDE10A (1.00) PDE10A
SCHEMBL13332064 0.97 PDE10A (1.00) PDE10A
SCHEMBL2489727 0.97 PDE10A (1.00) PDE10A
SCHEMBL13332059 0.97 PDE10A (1.00) PDE10A
SCHEMBL13332549 0.87 PDE10A (1.00) PDE10A
SCHEMBL13332541 0.87 PDE10A (1.00) PDE10A
SCHEMBL13332450 0.87 PDE10A (1.00) PDE10A
SCHEMBL13332446 0.87 PDE10A (1.00) 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
EP-2364306-A1 Pyridine and pyrimidine derivatives as phosphodiesterase 10 inhibitors Amgen Inc. (US) 2011-09-14 — — EP claimed
EP-2364306-A1 Pyridine and pyrimidine derivatives as phosphodiesterase 10 inhibitors Amgen Inc. (US) 2011-09-14 — — EP disclosed
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