SCHEMBL2763019

SCHEMBL2763019

O=C(CC(=S)S)c1cccc2c1Sc1ccccc1S2

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.35
BCHE P06276 8/20 0.33
PPARG P37231 1/20 0.32
CD69 Q07108 1/20 0.32
GAA P10253 2/20 0.31
MAPT P10636 2/20 0.31
ERCC5 P28715 3/20 0.31
FEN1 P39748 3/20 0.31
PTPN1 P18031 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPK1 P28482 1/20 0.31
SLC6A3 Q01959 1/20 0.31
ACHE P22303 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
SCHEMBL2762757 0.80 HDAC3 (0.38) BCHEGAAMAPT
SCHEMBL28751707 0.76 ALOX5 (0.44) ALOX5BCHECD69GAAMAPT
SCHEMBL28048826 0.76 CTSD (0.46) ALOX5BCHECD69GAAMAPT
SCHEMBL2763863 0.75 BCHE (0.45) BCHE
Thianthrene SCHEMBL30108387 0.73 ALDH1A1 (0.50) ALOX5BCHECD69GAAMAPT
SCHEMBL30944663 0.73 ALDH1A1 (0.50) ALOX5BCHECD69GAAMAPT
SCHEMBL2762894 0.73 ALDH1A1 (0.50) ALOX5BCHECD69GAAMAPT
SCHEMBL2762893 0.72 NOX1 (0.43) ALOX5BCHEGAAMAPTKDM4E
SCHEMBL9511389 0.71 KDM4E (0.50) BCHEGAAMAPTKDM4ESLC6A3
SCHEMBL11834948 0.70 ALOX5 (0.40) ALOX5BCHECD69GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1485377-B9 PYRANONES USEFUL AS ATM INHIBITORS KUDOS PHARM LTD (GB) 2010-10-06 EP disclosed
EP-1485377-B9 PYRANONES USEFUL AS ATM INHIBITORS KUDOS PHARM LTD (GB) 2010-10-06 EP disclosed
EP-2174939-A1 Pyranones useful as ATM inhibitors Kudos Pharmaceuticals Limited (GB) 2010-04-14 EP disclosed
EP-2174939-A1 Pyranones useful as ATM inhibitors Kudos Pharmaceuticals Limited (GB) 2010-04-14 EP disclosed
EP-1485377-B1 PYRANONES USEFUL AS ATM INHIBITORS KUDOS PHARM LTD (GB) 2009-12-09 EP disclosed
EP-1485377-B1 PYRANONES USEFUL AS ATM INHIBITORS KUDOS PHARM LTD (GB) 2009-12-09 EP disclosed
US-7049313-B2 ATM inhibitors KUDOS PHARMACEUTICALS LTD. (GB) 2006-05-23 US disclosed
EP-1485377-A1 PYRANONES USEFUL AS ATM INHIBITORS Kudos Pharmaceuticals Limited (GB) 2004-12-15 EP disclosed
US-20040002492-A1 Induce immunology response; anticancer agents KUDOS PHARMACEUTICALS LTD (GB) 2004-01-01 US disclosed
WO-2003070726-A1 PYRANONES USEFUL AS ATM INHIBITORS KUDOS PHARMACEUTICALS LTD (GB) 2003-08-28 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 (1 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-20040002492-A1 Induce immunology response; anticancer agents MYD88, IFNG, HCCS ALOX5 1515/4885BCHE 3812/4885PPARG 3218/4885

“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.