SCHEMBL1333403

SCHEMBL1333403

COc1ccc(S(=O)(=O)O)c2cccnc12

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
COMT P21964 2/20 0.63
KMT2A Q03164 2/20 0.63
MEN1 O00255 1/20 0.63
GLA P06280 1/20 0.63
TSHR P16473 1/20 0.63
ALDH1A1 P00352 6/20 0.61
HSD17B10 Q99714 4/20 0.61
GAA P10253 4/20 0.61
KDM4E B2RXH2 2/20 0.61
HPGD P15428 2/20 0.61
CYP1A2 P05177 1/20 0.60
ALOX15 P16050 1/20 0.60
HIF1A Q16665 1/20 0.60
POLB P06746 1/20 0.49
PDE4A P27815 1/20 0.49
PDE4B Q07343 1/20 0.49
PDE4C Q08493 1/20 0.49
PDE4D Q08499 1/20 0.49
LMNA P02545 2/20 0.48
FTO Q9C0B1 1/20 0.48

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
Actinoquinol SCHEMBL555260 0.85 ALDH1A1 (0.62) COMTKMT2AMEN1GLATSHR
Actinoquinol SCHEMBL32668968 0.85 ALDH1A1 (0.62) COMTKMT2AMEN1GLATSHR
SCHEMBL1332026 0.85 KMT2A (0.62) COMTKMT2AMEN1GLATSHR
SCHEMBL14919706 0.85 FTO (0.63) COMTKMT2AMEN1GLATSHR
Actinoquinol SCHEMBL3037156 0.84 ALDH1A1 (0.61) COMTKMT2AMEN1GLATSHR
Actinoquinol SCHEMBL3037161 0.84 ALDH1A1 (0.61) COMTKMT2AMEN1GLATSHR
Actinoquinol SCHEMBL1705425 0.84 ALDH1A1 (0.61) COMTKMT2AMEN1GLATSHR
SCHEMBL15725524 0.82 COMT (0.60) COMTKMT2AMEN1GLATSHR
SCHEMBL14601667 0.82 COMT (0.77) COMTKMT2AMEN1ALDH1A1HSD17B10
SCHEMBL3246768 0.82 KMT2A (0.53) KMT2AMEN1GLATSHRALDH1A1

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 48 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4726304-B2 2011-07-20 JP claimed
US-20070015737-A1 Compounds for inhibiting diseases and preparing cells for transplantation NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2007-01-18 US claimed
CN-1523992-A Compositions and methods for treating amyloidosis ʺ��ѧ 2004-08-25 CN claimed
JP-2003517458-A 2003-05-27 JP claimed
EP-1276483-A2 COMPOSITIONS AND METHODS FOR TREATING AMYLOIDOSIS USING SULPHONATE DERIVATIVES QUEEN'S UNIVERSITY AT KINGSTON (CA) 2003-01-22 EP claimed
EP-1237547-A2 COMPOUNDS FOR INHIBITING DISEASES AND PREPARING CELLS FOR TRANSPLANTATION ISIS INNOVATION LIMITED (GB) 2002-09-11 EP claimed
WO-2001003680-A2 COMPOUNDS FOR INHIBITING DISEASES AND PREPARING CELLS FOR TRANSPLANTATION ISIS INNOVATION LIMITED (GB) 2001-01-18 WO claimed
WO-2000064420-A2 COMPOSITIONS AND METHODS FOR TREATING AMYLOIDOSIS USING SULPHONATE DERIVATIVES QUEEN'S UNIVERSITY AT KINGSTON (CA) 2000-11-02 WO claimed
US-9763900-B2 Chemical chaperonins as novel molecular modulators of beta protein aggregation present in conformational diseases CENTRO DE NEUROCIENCIAS DE CUBA (CU) 2017-09-19 US disclosed
US-20160106691-A1 CHEMICAL CHAPERONINS AS NOVEL MOLECULAR MODULATORS OF BETA PROTEIN AGGREGATION PRESENT IN CONFORMATIONAL DISEASES CENTRO DE NEUROCIENCIAS DE CUBA (NEURONIC) (CU) 2016-04-21 US disclosed
US-20140329746-A1 METHODS AND COMPOSITIONS FOR TREATING AMYLOID-RELATED DISEASES NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2014-11-06 US disclosed
US-20140329746-A1 METHODS AND COMPOSITIONS FOR TREATING AMYLOID-RELATED DISEASES NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2014-11-06 US disclosed
US-8835654-B2 Method and compositions for treating amyloid-related diseases BHI LIMITED PARTNERSHIP (CA) 2014-09-16 US disclosed
US-8835654-B2 Method and compositions for treating amyloid-related diseases BHI LIMITED PARTNERSHIP (CA) 2014-09-16 US disclosed
EP-1227803-A2 METHODS AND COMPOUNDS FOR INHIBITING AMYLOID DEPOSITS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2002-08-07 EP disclosed
WO-2001003680-A3 COMPOUNDS FOR INHIBITING DISEASES AND PREPARING CELLS FOR TRANSPLANTATION ISIS INNOVATION (GB) 2002-07-11 WO disclosed
WO-2001003680-A2 COMPOUNDS FOR INHIBITING DISEASES AND PREPARING CELLS FOR TRANSPLANTATION ISIS INNOVATION LIMITED (GB) 2001-01-18 WO disclosed
WO-2001003680-A2 COMPOUNDS FOR INHIBITING DISEASES AND PREPARING CELLS FOR TRANSPLANTATION ISIS INNOVATION LIMITED (GB) 2001-01-18 WO disclosed
WO-2000071101-A2 METHODS AND COMPOUNDS FOR INHIBITING AMYLOID DEPOSITS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2000-11-30 WO disclosed
WO-2000064420-A2 COMPOSITIONS AND METHODS FOR TREATING AMYLOIDOSIS USING SULPHONATE DERIVATIVES QUEEN'S UNIVERSITY AT KINGSTON (CA) 2000-11-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140329746-A1 METHODS AND COMPOSITIONS FOR TREATING AMYLOID-RELATED DISEASES APP, PSEN1, PSEN2 COMT 559/4885KMT2A 4192/4885MEN1 1011/4885
US-20070015737-A1 Compounds for inhibiting diseases and preparing cells for transplantation IAPP, IDE, APP COMT 2739/4885KMT2A 4686/4885MEN1 547/4885
US-20160106691-A1 CHEMICAL CHAPERONINS AS NOVEL MOLECULAR MODULATORS OF BETA PROTEIN AGGREGATION PRESENT IN CONFORMATIONAL DISEASES HSPA2, HSPB1, HSP90AB2P COMT 3796/4885KMT2A 4306/4885MEN1 4570/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.