SCHEMBL570834

SCHEMBL570834

Fc1nc(Cl)cc2c1Oc1ccc(Br)cc1[C@]21N=Cc2ccncc21

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 10/20 0.33
CTSD P07339 1/20 0.30

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
SCHEMBL570867 0.82 BACE1 (0.51) BACE1
SCHEMBL570770 0.82 BACE1 (0.51) BACE1
SCHEMBL570684 0.82 BACE1 (0.51) BACE1
SCHEMBL10285177 0.80 BACE1 (0.37) BACE1CTSD
SCHEMBL10285131 0.80 BACE1 (0.37) BACE1CTSD
SCHEMBL10285126 0.80 BACE1 (0.37) BACE1CTSD
SCHEMBL570381 0.79
SCHEMBL570901 0.79
Trifluoroacetic Acid SCHEMBL15063416 0.74 BACE1 (0.36) BACE1CTSD
SCHEMBL2371316 0.72 BACE1 (0.39) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2601197-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) 2013-06-12 EP disclosed
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