SCHEMBL15510263

SCHEMBL15510263

NC1=N[C@@]2(CO1)c1cc(-c3cccnc3F)ccc1Oc1ccc(C3CCOCC3)nc12

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.78
CTSD P07339 12/20 0.78

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
SCHEMBL2016855 0.87 BACE1 (1.00) BACE1CTSD
SCHEMBL2383552 0.86 BACE1 (1.00) BACE1CTSD
SCHEMBL2372290 0.86 BACE1 (1.00) BACE1CTSD
SCHEMBL15510125 0.85 BACE1 (0.68) BACE1CTSD
SCHEMBL14877631 0.84 BACE1 (0.76) BACE1CTSD
SCHEMBL14878049 0.83 BACE1 (0.76) BACE1CTSD
SCHEMBL15509642 0.82 BACE1 (0.83) BACE1CTSD
SCHEMBL15509615 0.82 BACE1 (1.00) BACE1CTSD
SCHEMBL1995875 0.82 BACE1 (0.78) BACE1CTSD
SCHEMBL1995871 0.82 BACE1 (0.78) BACE1CTSD

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
EP-2328903-B1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETASECRETASE MODULATORS AND METHODS OF USE AMGEN INC (US) 2014-03-05 EP disclosed