SCHEMBL15664188

SCHEMBL15664188

COCCn1ccc(NC(=O)Oc2nc(C)ccc2Nc2cncnc2)n1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 19/20 0.48
ACSS2 Q9NR19 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
SCHEMBL15663486 0.86 PDE10A (0.51) PDE10A
SCHEMBL15663440 0.76 GRM5 (0.49) PDE10A
SCHEMBL15663568 0.76 PDE10A (0.40) PDE10A
SCHEMBL5207920 0.75 PDE10A (0.51) PDE10AACSS2
SCHEMBL15664015 0.75 PDE10A (0.41) PDE10A
SCHEMBL15663452 0.74 GRM5 (0.52) PDE10A
SCHEMBL15663531 0.74 PDE10A (0.40) PDE10A
SCHEMBL2826935 0.74 GRM5 (0.46) ACSS2
SCHEMBL15663798 0.74 NPC1 (0.44) PDE10A
SCHEMBL15663956 0.74 PDE10A (0.38) 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-1858854-B1 PYRIDINE-2-CARBOXAMIDE DERIVATIVES AS MGLUR5 ANTAGONISTS HOFFMANN LA ROCHE (CH) 2014-05-07 EP claimed