SCHEMBL12827752

SCHEMBL12827752

O=Nc1ccccc1OCC1CCN(Cc2ncc[nH]c2=O)CC1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACHE P22303 5/20 0.38
DCPS Q96C86 3/20 0.37
CYP2D6 P10635 1/20 0.35
GSK3B P49841 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
SCHEMBL1475655 0.85 ACHE (0.42) ACHE
SCHEMBL1474786 0.85 PKM (0.45) ACHEDCPS
SCHEMBL1475041 0.85 DCPS (0.44) DCPS
SCHEMBL1475382 0.85 MAPT (0.45) DCPS
SCHEMBL1475267 0.85 DCPS (0.44) DCPSCYP2D6
SCHEMBL12748688 0.85 ACHE (0.39) ACHEDCPSGSK3B
SCHEMBL1476053 0.84 MEN1 (0.43) DCPS
SCHEMBL1475638 0.83 ACHE (0.37) ACHEDCPS
SCHEMBL1476245 0.83 RBP4 (0.47) ACHEDCPS
SCHEMBL1477099 0.83 DCPS (0.47) DCPSCYP2D6

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
US-7915274-B2 Nitrogen containing heterocyclic compounds and medicines containing the same EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-03-29 US disclosed