SCHEMBL7943393

SCHEMBL7943393

CC#CCCOc1cnc(C(=O)Nc2cccc(C3(C)CC(=O)N(C)C(N)=N3)c2)cn1

nearest known ligand 0.85

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.85

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
SCHEMBL7945608 0.92 BACE1 (1.00) BACE1
SCHEMBL7944220 0.92 BACE1 (0.85) BACE1
SCHEMBL7941208 0.90 BACE1 (0.88) BACE1
SCHEMBL7943379 0.90 BACE1 (1.00) BACE1
SCHEMBL12301599 0.90 BACE1 (0.88) BACE1
SCHEMBL7933412 0.90 BACE1 (0.88) BACE1
SCHEMBL7941213 0.89 BACE1 (0.86) BACE1
SCHEMBL7944802 0.89 BACE1 (0.86) BACE1
SCHEMBL12303285 0.88 BACE1 (0.85) BACE1
SCHEMBL7941205 0.88 BACE1 (0.84) BACE1

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-2010047372-A1 2-AMINOPYRIDIN-4-ONE AND 2-AMINOPYRIDINE DERIVATIVE BOTH HAVING BACE1-INHIBITING ACTIVITY 塩野義製薬株式会社 (JP) 2010-04-29 WO disclosed