SCHEMBL973158

SCHEMBL973158

CNc1nccc(-c2cccnc2Oc2ccc(Nc3nc4ccccc4s3)cc2)n1

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 18/20 0.72
TEK Q02763 2/20 0.70
AURKA O14965 1/20 0.70
LCK P06239 1/20 0.70
KDR P35968 1/20 0.70
AURKB Q96GD4 1/20 0.70

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
SCHEMBL13332469 0.84 PDE10A (1.00) PDE10A
SCHEMBL2458740 0.83 PDE10A (1.00) PDE10A
SCHEMBL13332470 0.83 PDE10A (1.00) PDE10A
SCHEMBL971610 0.82 TEK (1.00) PDE10ATEKAURKALCKKDR
SCHEMBL2455751 0.82 PDE10A (1.00) PDE10A
SCHEMBL581474 0.82 TEK (0.68) TEKAURKAAURKB
SCHEMBL2465030 0.81 PDE10A (1.00) PDE10A
SCHEMBL2461627 0.81 PDE10A (1.00) PDE10A
SCHEMBL2459572 0.80 PDE10A (0.76) PDE10A
SCHEMBL2459409 0.80 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
US-7868177-B2 Multi-cyclic compounds and method of use AMGEN INC. (US) 2011-01-11 US claimed
EP-1994030-B1 MULTI-CYCLIC COMPOUNDS AND METHOD OF USE AMGEN INC (US) 2010-08-25 EP disclosed