SCHEMBL8710568

SCHEMBL8710568

Cc1cccc(C2C(=O)Oc3ccc(O)cc32)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.63
ALDH1A1 P00352 7/20 0.47
HPGD P15428 5/20 0.47
GLA P06280 1/20 0.47
HSD17B10 Q99714 1/20 0.46
MAPT P10636 5/20 0.43
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
THRB P10828 2/20 0.41
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
ACHE P22303 1/20 0.40
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
USP2 O75604 1/20 0.38
SIRT2 Q8IXJ6 1/20 0.38
ALDH2 P05091 1/20 0.37
KDM4E B2RXH2 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL8708250 0.84 GAA (0.64) GAAALDH1A1HPGDGLAHSD17B10
SCHEMBL571262 0.84 GAA (0.68) GAAALDH1A1HPGDGLAHSD17B10
SCHEMBL20630832 0.82 GAA (0.66) GAAALDH1A1MAPTMEN1KMT2A
SCHEMBL8802445 0.81 GAA (0.54) GAAALDH1A1HPGDGLAHSD17B10
SCHEMBL8810376 0.80 GAA (0.51) GAAALDH1A1HPGDGLAHSD17B10
SCHEMBL8811329 0.80 GAA (0.46) GAAALDH1A1HPGDGLAHSD17B10
SCHEMBL8711075 0.79 GAA (0.57) GAAALDH1A1HPGDGLAHSD17B10
SCHEMBL9573808 0.78 GAA (0.44) GAAALDH1A1HPGDGLAHSD17B10
SCHEMBL8706384 0.76 ALDH1A1 (0.52) GAAALDH1A1HPGDGLAMAPT
SCHEMBL8811388 0.76 GAA (0.44) GAAALDH1A1HPGDGLAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5717112-A Benzofuranone and benzodifuranone compounds ZENECA LIMITED (GB) 1998-02-10 US disclosed
EP-0669922-B1 BENZOFURANONES, BENZODIFURANTRIONES AND PROCESSES FOR THE PREPARATION OF BENZODIFURANDIONES BASF AG (DE) 1997-08-20 EP disclosed
US-5625080-A Benzodifurantrione compounds and process ZENECA LIMITED (GB) 1997-04-29 US disclosed
EP-0669922-A1 BENZOFURANONE AND BENZODIFURANTRIONE DERIVATIVES AND PROCESS FOR THE PREPARATION OF BENZODIFURANONES. ZENECA LTD (GB) 1995-09-06 EP disclosed
WO-1994012501-A1 BENZOFURANONE AND BENZODIFURANTRIONE DERIVATIVES AND PROCESS FOR THE PREPARATION OF BENZODIFURANONES ZENECA LIMITED (GB) 1994-06-09 WO disclosed
US-4916240-A Hetero-polycyclic aromatic compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-04-10 US disclosed
EP-0294029-A2 Hetero-polycyclic aromatic compounds ZENECA LIMITED (GB) 1988-12-07 EP disclosed