SCHEMBL15510609

SCHEMBL15510609

COc1cc2c(cc1F)Oc1ccc(-c3cncnc3)cc1[C@@]21COC(N)=N1

nearest known ligand 0.74

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.74
CTSD P07339 6/20 0.74
KCNH2 Q12809 8/20 0.64
CTSE P14091 1/20 0.61
BACE2 Q9Y5Z0 1/20 0.61

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
SCHEMBL15510324 1.00 BACE1 (0.74) BACE1CTSDKCNH2CTSEBACE2
SCHEMBL15509776 0.88 BACE1 (0.76) BACE1CTSDKCNH2CTSEBACE2
SCHEMBL15510508 0.88 BACE1 (0.76) BACE1CTSDKCNH2CTSEBACE2
SCHEMBL15510328 0.88 BACE1 (0.79) BACE1CTSDKCNH2CTSEBACE2
SCHEMBL15510317 0.87 BACE1 (0.79) BACE1CTSDKCNH2CTSEBACE2
SCHEMBL15510342 0.86 BACE1 (0.84) BACE1CTSDKCNH2CTSEBACE2
SCHEMBL15510359 0.86 BACE1 (0.84) BACE1CTSDKCNH2CTSEBACE2
SCHEMBL2013709 0.85 BACE1 (1.00) BACE1CTSDKCNH2CTSEBACE2
SCHEMBL2015648 0.85 BACE1 (1.00) BACE1CTSDKCNH2CTSEBACE2
SCHEMBL2013608 0.85 BACE1 (1.00) BACE1CTSDKCNH2CTSEBACE2

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