SCHEMBL1490723

SCHEMBL1490723

CC(C)n1c(=O)c2sc3c(=O)n(C(C)C)c(=O)c3sc2c1=O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.36
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
HCRTR1 O43613 1/20 0.34
GAA P10253 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL1729905 0.74 KMT2A (0.38) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL1318483 0.65 ALDH1A1 (0.42) MAPTALDH1A1KDM4EHCRTR1GAA
SCHEMBL4821904 0.62 ALDH1A1 (0.32) MAPTALDH1A1KDM4EHCRTR1GAA
SCHEMBL23430530 0.60 ALDH1A1 (0.38) MAPTMEN1HTTKMT2AALDH1A1
SCHEMBL22426651 0.59 ALDH1A1 (0.37) MAPTMEN1HTTKMT2AALDH1A1
SCHEMBL23008456 0.58 KDM4E (0.32) MAPTALDH1A1KDM4EHCRTR1GAA
SCHEMBL2757597 0.58 ALDH1A1 (0.33) MAPTALDH1A1KDM4EHCRTR1GAA
SCHEMBL21977159 0.58 ALDH1A1 (0.43) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL21787983 0.57 ADORA2B (0.41) MAPTALDH1A1KDM4EHCRTR1GAA
SCHEMBL21082580 0.56 KDM4E (0.34) MAPTALDH1A1KDM4EHCRTR1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160024108-A1 USE OF DITHIINE-TETRACARBOXIMIDES FOR CONTROLLING BACTERIAL HARMFUL ORGANISMS IN USEFUL PLANTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-01-28 US claimed
EP-2967068-A1 USE OF DITHIINE-TETRACARBOXIMIDES FOR CONTROLLING BACTERIAL HARMFUL ORGANISMS IN USEFUL PLANTS Bayer CropScience Aktiengesellschaft (DE) 2016-01-20 EP claimed
WO-2014139897-A1 USE OF DITHIINE-TETRACARBOXIMIDES FOR CONTROLLING BACTERIAL HARMFUL ORGANISMS IN USEFUL PLANTS BAYER CROPSCIENCE AG (DE) 2014-09-18 WO claimed
EP-2675277-A1 SYNERGISTIC COMBINATIONS CONTAINING A DITHIINO-TETRACARBOXAMIDE FUNGICIDE AND A HERBICIDE, SAFENER OR PLANT GROWTH REGULATOR Bayer Intellectual Property GmbH (DE) 2013-12-25 EP claimed
US-20130316901-A1 SYNERGISTIC COMBINATIONS CONTAINING A DITHINO-TETRACARBOXAMIDE FUNGICIDE AND A HERBICIDE, SAFENER OR PLANT GROWTH REGULATOR BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-11-28 US claimed
EP-2386203-B1 Use of dithiin tetracarboximides for combating phytopathogenic fungi BAYER CROPSCIENCE AG (DE) 2013-11-20 EP claimed
WO-2012110517-A1 SYNERGISTIC COMBINATIONS CONTAINING A DITHIINO-TETRACARBOXAMIDE FUNGICIDE AND A HERBICIDE, SAFENER OR PLANT GROWTH REGULATOR BAYER CROPSCIENCE AG (DE) 2012-08-23 WO claimed
EP-2454939-A1 Post-harvest treatment Bayer CropScience AG (DE) 2012-05-23 EP claimed
US-20110280958-A1 Active Compound Combinations BAYER CROPSCIENCE AG (DE) 2011-11-17 US claimed
US-20160286810-A1 ACTIVE COMPOUND COMBINATIONS BAYER CROPSCIENCE AG (DE) 2016-10-06 US disclosed
US-20160024108-A1 USE OF DITHIINE-TETRACARBOXIMIDES FOR CONTROLLING BACTERIAL HARMFUL ORGANISMS IN USEFUL PLANTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-01-28 US disclosed
EP-2967068-A1 USE OF DITHIINE-TETRACARBOXIMIDES FOR CONTROLLING BACTERIAL HARMFUL ORGANISMS IN USEFUL PLANTS Bayer CropScience Aktiengesellschaft (DE) 2016-01-20 EP disclosed
US-9192161-B2 Fungicidal combinations comprising a dithiino-tetracarboxamide fungicide BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-11-24 US disclosed
US-9155307-B2 Active compound combinations BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-10-13 US disclosed
WO-2011128300-A2 ACTIVE COMPOUND COMBINATIONS BAYER CROPSCIENCE AG (DE) 2011-10-20 WO disclosed
WO-2011061156-A1 ACTIVE COMPOUND COMBINATIONS BAYER CROPSCIENCE AG (DE) 2011-05-26 WO disclosed
US-20110118115-A1 Active compound combinations BAYER CROPSCIENCE AG (DE) 2011-05-19 US disclosed
US-20110064827-A1 Active compound combinations BAYER CROPSCIENCE AG (DE) 2011-03-17 US disclosed
US-20100120884-A1 USE OF DITHIINE-TETRACARBOXIMIDES FOR CONTROLLING PHYTOPATHOGENIC FUNGI BAYER CROPSCIENCE AG (DE) 2010-05-13 US disclosed
WO-2010043319-A1 USE OF DITHIIN TETRACARBOXIMIDES FOR TREATING PHYTOPATHOGENIC FUNGI BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-04-22 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 (7 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-20110064827-A1 Active compound combinations TST, DPM1, DDT MAPT 1665/4885MEN1 1599/4885HTT 1567/4885
US-20110118115-A1 Active compound combinations AADAC, ACACA, DDT MAPT 1634/4885MEN1 2540/4885HTT 2765/4885
US-20160286810-A1 ACTIVE COMPOUND COMBINATIONS TST, DPM1, BROX MAPT 1494/4885MEN1 1547/4885HTT 1863/4885
US-20130316901-A1 SYNERGISTIC COMBINATIONS CONTAINING A DITHINO-TETRACARBOXAMIDE FUNGICIDE AND A HERBICIDE, SAFENER OR PLANT GROWTH REGULATOR DDT, ING2, DNER MAPT 3855/4885MEN1 2634/4885HTT 1113/4885
US-20100120884-A1 USE OF DITHIINE-TETRACARBOXIMIDES FOR CONTROLLING PHYTOPATHOGENIC FUNGI TST, TTI1, DPM1 MAPT 1039/4885MEN1 1549/4885HTT 2679/4885
US-20110280958-A1 Active Compound Combinations TST, QDPR, SQOR MAPT 2098/4885MEN1 869/4885HTT 2324/4885
US-20160024108-A1 USE OF DITHIINE-TETRACARBOXIMIDES FOR CONTROLLING BACTERIAL HARMFUL ORGANISMS IN USEFUL PLANTS MGAM, PGLS, DGKI MAPT 1738/4885MEN1 4004/4885HTT 3978/4885

“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.