SCHEMBL918573

SCHEMBL918573

CCCCCCCCCCCCNS(=O)(=O)c1ccc2c(c1)C(=O)c1ccccc1C2=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARG Q86W56 6/20 0.61
ALDH1A1 P00352 5/20 0.59
MAPK1 P28482 3/20 0.58
HTT P42858 3/20 0.58
LMNA P02545 2/20 0.58
KMT2A Q03164 4/20 0.57
PKM P14618 4/20 0.55
GAA P10253 1/20 0.55
MEN1 O00255 3/20 0.55
TSHR P16473 2/20 0.55
POLB P06746 1/20 0.55
SMN1; SMN2 Q16637 3/20 0.51
KDM4E B2RXH2 1/20 0.51
MAPT P10636 2/20 0.51
RECQL P46063 1/20 0.51
EPHX2 P34913 1/20 0.48
PDK1 Q15118 1/20 0.47
PDK2 Q15119 1/20 0.47
PDK3 Q15120 1/20 0.47
PDK4 Q16654 1/20 0.47

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
SCHEMBL12942745 0.93 PARG (0.69) PARGALDH1A1MAPK1HTTLMNA
SCHEMBL20202316 0.87 ALDH1A1 (0.72) PARGALDH1A1MAPK1HTTLMNA
SCHEMBL11856638 0.82 ALDH1A1 (0.62) PARGALDH1A1MAPK1HTTLMNA
SCHEMBL11856067 0.82 ALDH1A1 (0.62) PARGALDH1A1MAPK1HTTLMNA
Hydrochloric Acid SCHEMBL11858657 0.81 ALDH1A1 (0.60) PARGALDH1A1MAPK1HTTLMNA
SCHEMBL29902418 0.81 PKM (0.71) PARGALDH1A1MAPK1HTTLMNA
SCHEMBL9942078 0.80 NPY1R (0.67) ALDH1A1MAPK1HTTLMNAGAA
SCHEMBL633906 0.79 ALDH1A1 (0.82) ALDH1A1MAPK1HTTLMNAKMT2A
SCHEMBL578832 0.79 ALDH1A1 (0.82) ALDH1A1MAPK1HTTLMNAKMT2A
SCHEMBL1279062 0.79 ALDH1A1 (0.82) ALDH1A1MAPK1HTTLMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110015295-A1 ADDITIVE MIXTURES FOR AGRICULTURAL ARTICLES GARDI STEFANO 2011-01-20 US claimed
US-20090076206-A1 Additive Mixtures for Agricultural Articles CIBA SPECIALTY CHEMICALS CORP. 2009-03-19 US claimed
CN-101151315-A Additive mixtures for agricultural articles CIBA SPECIALITY CHEMICALS S P (CH) 2008-03-26 CN claimed
US-20110015295-A1 ADDITIVE MIXTURES FOR AGRICULTURAL ARTICLES GARDI STEFANO 2011-01-20 US disclosed
US-20110015295-A1 ADDITIVE MIXTURES FOR AGRICULTURAL ARTICLES GARDI STEFANO 2011-01-20 US disclosed
US-20110015295-A1 ADDITIVE MIXTURES FOR AGRICULTURAL ARTICLES GARDI STEFANO 2011-01-20 US disclosed
US-20090076206-A1 Additive Mixtures for Agricultural Articles CIBA SPECIALTY CHEMICALS CORP. 2009-03-19 US disclosed
US-20090076206-A1 Additive Mixtures for Agricultural Articles CIBA SPECIALTY CHEMICALS CORP. 2009-03-19 US disclosed
US-20090076206-A1 Additive Mixtures for Agricultural Articles CIBA SPECIALTY CHEMICALS CORP. 2009-03-19 US disclosed
CN-101151315-A Additive mixtures for agricultural articles CIBA SPECIALITY CHEMICALS S P (CH) 2008-03-26 CN disclosed
EP-1866367-A2 ADDITIVE MIXTURES FOR AGRICULTURAL ARTICLES CIBA SPECIALTY CHEMICALS HOLDING INC. Patent Departement (CH) 2007-12-19 EP disclosed
WO-2006106049-A2 ADDITIVE MIXTURES FOR AGRICULTURAL ARTICLES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2006-10-12 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 (2 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-20110015295-A1 ADDITIVE MIXTURES FOR AGRICULTURAL ARTICLES ACMSD, SCD5, DEGS1 PARG 43/4885ALDH1A1 938/4885MAPK1 3166/4885
US-20090076206-A1 Additive Mixtures for Agricultural Articles SOD1, PPOX, CYBB PARG 531/4885ALDH1A1 1994/4885MAPK1 1229/4885

“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.