SCHEMBL19372153

SCHEMBL19372153

Cn1ncc(NC(=O)Oc2nc(C3CC3)cnc2Nc2cncnc2)c1C(=O)NCC1CCCO1

nearest known ligand 0.79

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 20/20 0.79

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
SCHEMBL19372338 1.00 PDE10A (0.79) PDE10A
SCHEMBL19372293 1.00 PDE10A (0.79) PDE10A
SCHEMBL7518510 0.88 PDE10A (1.00) PDE10A
SCHEMBL12068075 0.88 PDE10A (1.00) PDE10A
SCHEMBL15417208 0.88 PDE10A (1.00) PDE10A
SCHEMBL19372101 0.87 PDE10A (0.80) PDE10A
SCHEMBL19372360 0.87 PDE10A (0.76) PDE10A
SCHEMBL19372189 0.85 PDE10A (0.77) PDE10A
SCHEMBL19372151 0.85 PDE10A (0.77) PDE10A
SCHEMBL19372121 0.85 PDE10A (0.75) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2580207-B1 NITROGEN CONTAINING HETEROARYL COMPOUNDS HOFFMANN LA ROCHE (CH) 2017-09-27 EP claimed