SCHEMBL8225796

SCHEMBL8225796

Cc1cccc(C2(c3ccccc3)N=C(N)N3CCCN=C32)c1

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.78
BACE2 Q9Y5Z0 11/20 0.78
APP P05067 1/20 0.78
CTSD P07339 11/20 0.71

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
SCHEMBL8223357 0.93 BACE1 (0.71) BACE1BACE2APPCTSD
SCHEMBL3456304 0.88 BACE1 (1.00) BACE1BACE2APPCTSD
SCHEMBL4883164 0.85 BACE1 (0.78) BACE1BACE2APPCTSD
SCHEMBL3457675 0.85 BACE1 (1.00) BACE1BACE2APPCTSD
SCHEMBL3457576 0.83 BACE1 (1.00) BACE1BACE2APPCTSD
SCHEMBL3457106 0.82 BACE1 (1.00) BACE1BACE2APPCTSD
SCHEMBL8225647 0.82 BACE1 (0.86) BACE1BACE2APPCTSD
SCHEMBL8227182 0.81 BACE1 (0.72) BACE1BACE2APPCTSD
SCHEMBL8228776 0.81 BACE1 (0.56) BACE1BACE2APPCTSD
SCHEMBL14258096 0.81 BACE1 (0.88) BACE1BACE2APPCTSD

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-2007145569-A1 AMINO-IMIDAZOLONES AND THEIR USE AS A MEDICAMENT FOR TREATING COGNITIVE IMPAIRMENT, ALZHEIMER DISEASE, NEURODEGENERATION AND DEMENTIA ASTRAZENECA AB (SE) 2007-12-21 WO disclosed