SCHEMBL2370816

SCHEMBL2370816

NC1=NC2(CO1)c1cc(OS(=O)(=O)C(F)(F)F)ccc1Oc1c(F)cc(N3CCCC3=O)cc12

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.45
CTSD P07339 5/20 0.42
KCNH2 Q12809 4/20 0.40

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
SCHEMBL2371472 1.00 BACE1 (0.45) BACE1CTSDKCNH2
SCHEMBL2371249 0.88 BACE1 (0.55) BACE1CTSD
SCHEMBL2371254 0.88 BACE1 (0.55) BACE1CTSD
SCHEMBL2521862 0.86 BACE1 (0.61) BACE1CTSDKCNH2
SCHEMBL2521865 0.86 BACE1 (0.61) BACE1CTSDKCNH2
SCHEMBL2371435 0.83 BACE1 (0.49) BACE1CTSDKCNH2
SCHEMBL2371440 0.83 BACE1 (0.49) BACE1CTSDKCNH2
SCHEMBL2371212 0.78 BACE1 (0.59) BACE1CTSDKCNH2
SCHEMBL2371213 0.78 BACE1 (0.59) BACE1CTSDKCNH2
SCHEMBL1997683 0.78 BACE1 (0.64) BACE1CTSDKCNH2

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