SCHEMBL8710310

SCHEMBL8710310

Cc1ccc(C2C(=O)Oc3cc4c(cc32)OC(=O)C4=O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.56
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
MAPT P10636 3/20 0.39
RECQL P46063 1/20 0.39
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
CASP1 P29466 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
THRB P10828 2/20 0.36
POLB P06746 1/20 0.35
GRK6 P43250 1/20 0.35
ALDH2 P05091 1/20 0.35
MAOB P27338 5/20 0.33
GLA P06280 1/20 0.33

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
SCHEMBL1685239 0.87 GAA (0.56) GAAMEN1KMT2AMAPTALDH1A1
SCHEMBL8710767 0.86 GAA (0.53) GAAMEN1KMT2AMAPTALDH1A1
SCHEMBL8710560 0.85 MAPT (0.44) GAAMEN1KMT2AMAPTALDH1A1
SCHEMBL8805318 0.84 GAA (0.50) GAAKMT2AMAPTALDH1A1KDM4E
SCHEMBL8710451 0.82 ALDH1A1 (0.41) GAAMEN1KMT2AMAPTALDH1A1
SCHEMBL8704453 0.82 GAA (0.40) GAAMEN1KMT2AMAPTALDH1A1
SCHEMBL8804803 0.81 GAA (0.49) GAAMEN1KMT2AMAPTALDH1A1
SCHEMBL8710118 0.80 GAA (0.39) GAAMEN1KMT2AMAPTALDH1A1
SCHEMBL20631015 0.74 GAA (0.67) GAAMEN1KMT2AMAPTRECQL
SCHEMBL8708250 0.72 GAA (0.64) GAAMEN1KMT2AMAPTALDH1A1

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 5 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