SCHEMBL12068902

SCHEMBL12068902

C=C/C=C\c1c(C)ccn2cc(CCc3ccc4ncccc4n3)nc12

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 16/20 0.46

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
SCHEMBL12068220 0.78 PDE10A (0.53) PDE10A
SCHEMBL12068221 0.75 PDE10A (0.74) PDE10A
SCHEMBL7553385 0.73 PDE10A (0.64) PDE10A
SCHEMBL12067666 0.71 PDE10A (0.80) PDE10A
SCHEMBL12067664 0.69 PDE10A (0.52) PDE10A
SCHEMBL20123934 0.67 PDE10A (0.46) PDE10A
SCHEMBL15023646 0.66 PDE10A (0.64) PDE10A
SCHEMBL16449237 0.65 MAPT (0.46)
SCHEMBL12066285 0.65 PDE10A (0.57) PDE10A
SCHEMBL12068325 0.64 PDE10A (0.36) 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
WO-2011150156-A2 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2011-12-01 WO disclosed