SCHEMBL10285405

SCHEMBL10285405

C/N=C(/N)c1ccncc1[C@@H]1c2cc(-c3cccnc3F)ccc2Oc2c1cc(Cl)nc2F

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.42
CTSD P07339 3/20 0.34
CTSE P14091 1/20 0.34
BACE2 Q9Y5Z0 1/20 0.34

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
SCHEMBL10285710 0.66 BACE1 (0.51) BACE1CTSD
SCHEMBL10285133 0.65 BACE1 (0.56) BACE1CTSD
SCHEMBL10285408 0.65 BACE1 (0.56) BACE1CTSD
SCHEMBL10285424 0.65 BACE1 (0.56) BACE1CTSD
SCHEMBL570770 0.64 BACE1 (0.51) BACE1
SCHEMBL570684 0.64 BACE1 (0.51) BACE1
SCHEMBL570867 0.64 BACE1 (0.51) BACE1
SCHEMBL10285111 0.62 BACE1 (0.59) BACE1
SCHEMBL10285496 0.62 BACE1 (0.59) BACE1
SCHEMBL570820 0.62 BACE1 (0.59) BACE1

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
WO-2012019056-A1 AMINO-ISO-INDOLE, AMINO-AZA-ISO-INDOLE, AMINO-DIHYDROISOQUINOLINE AND AMINO-BENZOXAZINE COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2012-02-09 WO disclosed