SCHEMBL12445909

SCHEMBL12445909

COCC#CCOc1cnc(C(=O)Nc2ccnc(CNc3cccnc3N)c2)cn1

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 19/20 0.68
BACE2 Q9Y5Z0 2/20 0.41
APP P05067 1/20 0.39
PRKCI P41743 1/20 0.39

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
SCHEMBL7944986 0.93 BACE1 (0.68) BACE1BACE2APPPRKCI
SCHEMBL7946763 0.92 BACE1 (0.66) BACE1BACE2APPPRKCI
SCHEMBL12445765 0.92 BACE1 (0.79) BACE1BACE2APP
SCHEMBL12445787 0.92 BACE1 (0.66) BACE1BACE2APPPRKCI
SCHEMBL12445978 0.92 BACE1 (0.65) BACE1BACE2APP
SCHEMBL7940563 0.91 BACE1 (0.65) BACE1BACE2APPPRKCI
SCHEMBL7943510 0.90 BACE1 (0.78) BACE1PRKCI
SCHEMBL7945386 0.89 BACE1 (0.78) BACE1BACE2
SCHEMBL7940587 0.89 BACE1 (0.77) BACE1BACE2PRKCI
SCHEMBL7940752 0.88 BACE1 (0.86) BACE1BACE2

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-2360155-A1 2-AMINOPYRIDIN-4-ONE AND 2-AMINOPYRIDINE DERIVATIVE BOTH HAVING BACE1-INHIBITING ACTIVITY Shionogi & Co., Ltd. (JP) 2011-08-24 EP disclosed