SCHEMBL15510508

SCHEMBL15510508

CCCOc1cc2c(cc1F)Oc1ccc(-c3cncnc3)cc1[C@]21COC(N)=N1

nearest known ligand 0.76

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.76
CTSD P07339 5/20 0.76
KCNH2 Q12809 10/20 0.62
CTSE P14091 1/20 0.62
BACE2 Q9Y5Z0 1/20 0.62

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
SCHEMBL15509776 1.00 BACE1 (0.76) BACE1CTSDKCNH2CTSEBACE2
SCHEMBL15509794 0.91 BACE1 (0.78) BACE1CTSDKCNH2CTSEBACE2
SCHEMBL15509897 0.91 BACE1 (0.78) BACE1CTSDKCNH2CTSEBACE2
SCHEMBL15510355 0.90 BACE1 (0.65) BACE1CTSDKCNH2CTSEBACE2
SCHEMBL15510265 0.90 BACE1 (0.65) BACE1CTSDKCNH2CTSEBACE2
SCHEMBL15510317 0.89 BACE1 (0.79) BACE1CTSDKCNH2CTSEBACE2
SCHEMBL15510324 0.88 BACE1 (0.74) BACE1CTSDKCNH2CTSEBACE2
SCHEMBL15510609 0.88 BACE1 (0.74) BACE1CTSDKCNH2CTSEBACE2
SCHEMBL15510359 0.87 BACE1 (0.84) BACE1CTSDKCNH2CTSEBACE2
SCHEMBL15510342 0.87 BACE1 (0.84) 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