SCHEMBL2575233

SCHEMBL2575233

Cc1cccc2c1C1(N=CNC1=O)c1ccccc1O2

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
CNR1 P21554 1/20 0.30
HTT P42858 1/20 0.30
GPR35 Q9HC97 1/20 0.30
GPR55 Q9Y2T6 1/20 0.30
KDM4E B2RXH2 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
SCHEMBL2575231 0.69 KDM4E (0.35) ALDH1A1KDM4E
SCHEMBL25704818 0.68 ALOX5 (0.34) HTT
SCHEMBL29599802 0.65 MAPT (0.52) ALDH1A1MAPTHTTGPR55
SCHEMBL4500876 0.64 TSHR (0.41)
SCHEMBL24969145 0.64 ESR1 (0.39) MAPTHTTKDM4E
SCHEMBL6786858 0.64 ALOX5 (0.38) HTT
SCHEMBL10784280 0.64 MAPT (0.48) ALDH1A1MAPTHTTGPR55
SCHEMBL23460351 0.64 CYP1A2 (0.32) HTT
SCHEMBL2575229 0.63 MAPT (0.34) ALDH1A1MAPTHTTKDM4E
SCHEMBL29178999 0.63 OPRM1 (0.50)

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 3 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 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
WO-2011130741-A1 COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES ARRAY BIOPHARMA INC. (US) 2011-10-20 WO disclosed