SCHEMBL2372035

SCHEMBL2372035

CC1(/C=C/c2cnc3c(c2)[C@]2(COC(N)=N2)c2cc(O)ccc2O3)COC1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.47
KCNH2 Q12809 7/20 0.47
BACE2 Q9Y5Z0 2/20 0.45
CTSD P07339 1/20 0.45

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
SCHEMBL2372045 1.00 BACE1 (0.47) BACE1KCNH2BACE2CTSD
SCHEMBL2372049 1.00 BACE1 (0.47) BACE1KCNH2BACE2CTSD
SCHEMBL2371902 0.84 BACE1 (0.57) BACE1KCNH2BACE2CTSD
SCHEMBL2371908 0.84 BACE1 (0.57) BACE1KCNH2BACE2CTSD
SCHEMBL2371909 0.84 BACE1 (0.57) BACE1KCNH2BACE2CTSD
SCHEMBL15494518 0.83 BACE1 (0.48) BACE1KCNH2BACE2CTSD
SCHEMBL6845300 0.83 BACE1 (0.48) BACE1KCNH2BACE2CTSD
SCHEMBL13383290 0.83 BACE1 (0.52) BACE1KCNH2BACE2CTSD
SCHEMBL2524869 0.82 BACE1 (0.51) BACE1KCNH2BACE2CTSD
SCHEMBL2383628 0.82 BACE1 (0.60) BACE1KCNH2BACE2CTSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2547685-A1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETA - SECRETASE MODULATORS Amgen Inc. (US) 2013-01-23 EP disclosed
WO-2011115938-A1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETA - SECRETASE MODULATORS AMGEN INC. (US) 2011-09-22 WO disclosed