SCHEMBL14877667

SCHEMBL14877667

CC1(C#Cc2cnc3c(c2)[C@]2(COC(N)=N2)c2cc(-c4cccnc4)ccc2O3)COC1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.76
BACE2 Q9Y5Z0 3/20 0.76
CTSD P07339 3/20 0.76
KCNH2 Q12809 7/20 0.58

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
SCHEMBL2384469 0.89 BACE1 (0.73) BACE1BACE2CTSDKCNH2
SCHEMBL15510499 0.88 BACE1 (0.69) BACE1BACE2CTSDKCNH2
SCHEMBL2372030 0.88 BACE1 (0.68) BACE1BACE2CTSDKCNH2
SCHEMBL2372377 0.88 BACE1 (0.71) BACE1BACE2CTSDKCNH2
SCHEMBL2372373 0.88 BACE1 (0.71) BACE1BACE2CTSDKCNH2
SCHEMBL2381866 0.88 BACE1 (0.75) BACE1BACE2CTSDKCNH2
SCHEMBL2019582 0.87 BACE1 (0.76) BACE1BACE2CTSDKCNH2
SCHEMBL2370984 0.87 BACE1 (0.76) BACE1BACE2CTSDKCNH2
SCHEMBL2013687 0.87 BACE1 (0.76) BACE1BACE2CTSDKCNH2
SCHEMBL15509653 0.87 BACE1 (0.76) BACE1BACE2CTSDKCNH2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2328903-B1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETASECRETASE MODULATORS AND METHODS OF USE AMGEN INC (US) 2014-03-05 EP disclosed
US-8426447-B2 Spiro-tricyclic ring compounds as beta-secretase modulators and methods of use AMGEN INC. (US) 2013-04-23 US disclosed
US-8426447-B2 Spiro-tricyclic ring compounds as beta-secretase modulators and methods of use AMGEN INC. (US) 2013-04-23 US disclosed