SCHEMBL813013

SCHEMBL813013

Cc1ccc(C(=O)S)c2snnc12

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.36
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
TP53 P04637 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PKM P14618 1/20 0.33
AHR P35869 1/20 0.31
GAA P10253 1/20 0.31
POLB P06746 2/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL7249951 0.85 MCL1 (0.37) MAPTMEN1KMT2ATP53SMN1; SMN2
SCHEMBL674068 0.78
SCHEMBL17694350 0.76 AHR (0.32) MAPTMEN1KMT2ATP53SMN1; SMN2
Hydrochloric Acid SCHEMBL17701156 0.68 MAPT (0.35) MAPTMEN1KMT2ATP53SMN1; SMN2
SCHEMBL21969484 0.67
SCHEMBL18905978 0.66 GAA (0.31) GAAALDH1A1
SCHEMBL28452343 0.64 ALDH1A1 (0.36) MAPTMEN1KMT2ATP53SMN1; SMN2
SCHEMBL21970018 0.63
SCHEMBL21969715 0.62
SCHEMBL20258583 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2533633-B1 FUNGICIDAL MIXTURES LANXESS DISTRIB GMBH (DE) 2017-02-01 EP claimed
US-20130195997-A1 FUNGICIDAL MIXTURES LANXESS DISTRIBUTION GMBH (DE) 2013-08-01 US claimed
EP-2533633-A2 FUNGICIDAL MIXTURES LANXESS Distribution GmbH (DE) 2012-12-19 EP claimed
US-20110319435-A1 FUNGICIDE MIXTURES LANXESS DISTRIBUTION GMBH (DE) 2011-12-29 US claimed
WO-2011095492-A2 FUNGICIDAL MIXTURES LANXESS DISTRIBUTION GMBH (DE) 2011-08-11 WO claimed
EP-2315522-A2 FORMATE-CONTAINING FUNGICIDE MIXTURES LANXESS Distribution GmbH (DE) 2011-05-04 EP claimed
EP-2153720-A1 Fungicide mixtures comprising formate LANXESS Distribution GmbH (DE) 2010-02-17 EP claimed
WO-2010015635-A2 FUNGICIDE MIXTURES LANXESS DISTRIBUTION GMBH (DE) 2010-02-11 WO claimed
US-20170367330-A1 Method for stimulating induced insect resistance of rice ZHENJIANG UNIV (CN) 2017-12-28 US disclosed
EP-2533633-B1 FUNGICIDAL MIXTURES LANXESS DISTRIB GMBH (DE) 2017-02-01 EP disclosed
US-20160152578-A1 CRYSTALLINE MODIFICATIONS OF PROTHIOCONAZOLE ADAMA MAKHTESHIM LTD (IL) 2016-06-02 US disclosed
US-9290461-B2 Crystalline modifications of prothioconazole ADAMA MAKHTESHIM LTD (IL) 2016-03-22 US disclosed
CN-105145572-A Method for stimulating rice induced insect resistance UNIV ZHEJIANG 2015-12-16 CN disclosed
EP-2233466-B1 4-Alkoxy-1-amino-1-cyclohexanecarboxylic acid derivatives and their use as intermediates BAYER IP GMBH (DE) 2015-06-10 EP disclosed
WO-1997048280-A1 USE OF PYRROLOPYRIMIDINES TO COMBAT PESTS BAYER AKTIENGESELLSCHAFT (DE) 1997-12-24 WO disclosed
WO-1997047620-A1 N-SULFONYLIMIDAZOLES USED AS FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-12-18 WO disclosed
WO-1997047606-A1 ARYLOXYACRYLIC ACID ESTERS BAYER AKTIENGESELLSCHAFT (DE) 1997-12-18 WO disclosed
WO-1997047589-A1 AMINOPHTHALIC ACID DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1997-12-18 WO disclosed
WO-1997026251-A1 ACYLATED 5-AMINO-1,2,4-THIADIAZOLES AS PESTICIDES AND FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-07-24 WO disclosed
WO-1997008135-A1 ACYLAMINOSALICYLIC ACID AMIDES AND THEIR USES AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-03-06 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-20160152578-A1 CRYSTALLINE MODIFICATIONS OF PROTHIOCONAZOLE RPL23A, CASP3, NOX3 MAPT 2787/4885MEN1 3168/4885KMT2A 3883/4885
US-20170367330-A1 Method for stimulating induced insect resistance of rice POF1B, FSHR, LPXN MAPT 4855/4885MEN1 4490/4885KMT2A 1429/4885

“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.