SCHEMBL2762893

SCHEMBL2762893

CC(=O)c1cccc2c1Sc1ccccc1S2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 3/20 0.43
ALOX5 P09917 1/20 0.41
BCHE P06276 9/20 0.40
KMT2A Q03164 3/20 0.39
MAPT P10636 2/20 0.39
MEN1 O00255 2/20 0.39
CYBB P04839 1/20 0.39
APP P05067 1/20 0.39
GAA P10253 1/20 0.39
ALOX15 P16050 1/20 0.39
SNCA P37840 1/20 0.39
NOX3 Q9HBY0 1/20 0.39
NOX4 Q9NPH5 1/20 0.39
LMNA P02545 4/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ACHE P22303 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL28751707 0.86 ALOX5 (0.44) NOX1ALOX5BCHEKMT2AMAPT
SCHEMBL30944663 0.82 ALDH1A1 (0.50) ALOX5BCHEKMT2AMAPTGAA
Thianthrene SCHEMBL30108387 0.82 ALDH1A1 (0.50) ALOX5BCHEKMT2AMAPTGAA
SCHEMBL2762894 0.82 ALDH1A1 (0.50) ALOX5BCHEKMT2AMAPTGAA
SCHEMBL9511389 0.80 KDM4E (0.50) BCHEKMT2AMAPTMEN1GAA
SCHEMBL8504210 0.80 NOX1 (0.40) NOX1ALOX5BCHEKMT2AMAPT
SCHEMBL11834948 0.79 ALOX5 (0.40) NOX1ALOX5BCHEKMT2AMAPT
SCHEMBL28048826 0.78 CTSD (0.46) ALOX5BCHEKMT2AMAPTMEN1
SCHEMBL7790465 0.78 ALOX5 (0.36) NOX1ALOX5KMT2AMEN1KDM4E
Thianthrene SCHEMBL8504206 0.74 NOX1 (0.56) NOX1BCHEKMT2AMAPTMEN1

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
US-20040002492-A1 Induce immunology response; anticancer agents KUDOS PHARMACEUTICALS LTD (GB) 2004-01-01 US disclosed
US-5858573-A USING A CLASS OF COMPOUNDS CONSISTING OF THIANTHRENE AND ITS DERIVATIVES AS REDOX SHUTTLE REAGENTS TO PROVIDE OVERCHARGE PROTECTION EIC LABORATORIES, INC. (US) 1999-01-12 US disclosed
EP-0825663-A2 Chemical overcharge protection of lithium and lithium-ion secondary batteries EIC Laboratories, Inc. (US) 1998-02-25 EP 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 NOX1 124/4885ALOX5 1515/4885BCHE 3812/4885

“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.