SCHEMBL7710439

SCHEMBL7710439

Cc1cc(-c2nccnc2OC2CCNCC2)ccn1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 2/20 0.53
▸ TLR7 Q9NYK1 10/20 0.44
▸ TLR8 Q9NR97 9/20 0.44
▸ TLR9 Q9NR96 8/20 0.44
▸ LRRK2 Q5S007 1/20 0.43
▸ MAPK1 P28482 1/20 0.43

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
Hydrochloric Acid SCHEMBL15134941 0.99 PDE10A (0.52) PDE10ATLR7TLR8TLR9LRRK2
SCHEMBL17456029 0.83 PDE10A (0.47) PDE10ALRRK2
SCHEMBL7704633 0.82 PDE10A (0.56) PDE10ATLR7TLR8TLR9
Hydrochloric Acid SCHEMBL15134886 0.81 PDE10A (0.55) PDE10ATLR7TLR8TLR9
SCHEMBL12696756 0.76 ROCK1 (0.55) TLR7TLR8TLR9
Hydrochloric Acid SCHEMBL17456014 0.74 PRKCI (0.50) PDE10A
SCHEMBL2631068 0.73 PDE10A (0.82) PDE10A
SCHEMBL2630915 0.70 PDE10A (0.51) PDE10A
SCHEMBL4111572 0.70 HTR1A (0.55) PDE10A
SCHEMBL2631010 0.69 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9376450-B2 Heteroaryloxyheterocyclyl compounds as PDE10 inhibitors AMGEN INC. (US) 2016-06-28 — — US disclosed
US-9376450-B2 Heteroaryloxyheterocyclyl compounds as PDE10 inhibitors AMGEN INC. (US) 2016-06-28 — — US disclosed
US-8497265-B2 Heteroaryloxyheterocyclyl compounds as PDE10 inhibitors AMGEN INC. (US) 2013-07-30 — — US disclosed
US-8497265-B2 Heteroaryloxyheterocyclyl compounds as PDE10 inhibitors AMGEN INC. (US) 2013-07-30 — — US disclosed
WO-2011143495-A1 HETEROARYLOXYHETEROCYCLYL COMPOUNDS AS PDE10 INHIBITORS AMGEN INC. (US) 2011-11-17 — — WO disclosed
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