SCHEMBL8533444

SCHEMBL8533444

COc1ccc2c(c1)[C@]1(N=C(N)N(C)C1=O)c1cc(-c3cncnc3)ccc1O2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 1.00
CTSD P07339 11/20 0.59
BACE2 Q9Y5Z0 2/20 0.51
REN P00797 1/20 0.51

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
SCHEMBL2571649 1.00 BACE1 (1.00) BACE1CTSDBACE2REN
SCHEMBL16487873 1.00 BACE1 (1.00) BACE1CTSDBACE2REN
SCHEMBL7710740 0.95 BACE1 (0.91) BACE1CTSDBACE2REN
SCHEMBL2571922 0.92 BACE1 (0.84) BACE1CTSDBACE2
SCHEMBL2574976 0.91 BACE1 (0.84) BACE1CTSDBACE2
SCHEMBL7709516 0.89 BACE1 (0.85) BACE1CTSDBACE2REN
SCHEMBL7715225 0.89 BACE1 (0.79) BACE1CTSDBACE2REN
SCHEMBL2572696 0.89 BACE1 (0.79) BACE1CTSDBACE2
SCHEMBL7711676 0.88 BACE1 (0.78) BACE1CTSDBACE2
SCHEMBL7708603 0.87 BACE1 (0.77) BACE1CTSDBACE2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2643325-A1 SPIRO-AMINO-IMIDAZOLONE AND SPIRO-AMINO-DIHYDRO-PYRIMIDINONE COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE Amgen Inc. (US) 2013-10-02 EP claimed
WO-2012071279-A1 SPIRO-AMINO-IMIDAZOLONE AND SPIRO-AMINO-DIHYDRO-PYRIMIDINONE COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2012-05-31 WO claimed
US-8957083-B2 Spiro-amino-imidazolone and spiro-amino-dihydro-pyrimidinone compounds as beta-secretase modulators and methods of use AMGEN INC. (US) 2015-02-17 US disclosed
US-8957083-B2 Spiro-amino-imidazolone and spiro-amino-dihydro-pyrimidinone compounds as beta-secretase modulators and methods of use AMGEN INC. (US) 2015-02-17 US disclosed
EP-2643325-A1 SPIRO-AMINO-IMIDAZOLONE AND SPIRO-AMINO-DIHYDRO-PYRIMIDINONE COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE Amgen Inc. (US) 2013-10-02 EP disclosed
WO-2012071279-A1 SPIRO-AMINO-IMIDAZOLONE AND SPIRO-AMINO-DIHYDRO-PYRIMIDINONE COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2012-05-31 WO disclosed