SCHEMBL15510399

SCHEMBL15510399

NC1=N[C@@]2(CO1)c1cc(-c3cccnc3F)ccc1Oc1cnc(-c3ccccc3)cc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 1.00
CTSD P07339 16/20 1.00

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
SCHEMBL2009429 0.94 BACE1 (1.00) BACE1CTSD
SCHEMBL15510654 0.93 BACE1 (0.88) BACE1CTSD
SCHEMBL2016987 0.93 BACE1 (1.00) BACE1CTSD
SCHEMBL15510528 0.92 BACE1 (1.00) BACE1CTSD
SCHEMBL15418968 0.91 BACE1 (0.83) BACE1CTSD
SCHEMBL15509750 0.91 BACE1 (0.84) BACE1CTSD
SCHEMBL15510075 0.90 BACE1 (0.82) BACE1CTSD
SCHEMBL2371177 0.90 BACE1 (1.00) BACE1CTSD
SCHEMBL2371168 0.90 BACE1 (1.00) BACE1CTSD
SCHEMBL15509987 0.90 BACE1 (0.84) 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