Captan

Captan

SCHEMBL4449508

O=C1C2CC=CCC2C(=O)N1SC(Cl)(Cl)Cl.O=C1NC(=O)c2ccccc21

nearest known ligand 0.69

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.69
LMNA P02545 2/20 0.69
TP53 P04637 2/20 0.69
HSD17B10 Q99714 2/20 0.69
TSHR P16473 2/20 0.69
CYP3A4 P08684 1/20 0.69
HPGD P15428 1/20 0.69
ALOX15 P16050 1/20 0.69
MAPK1 P28482 1/20 0.69
HTT P42858 1/20 0.69
KMT2A Q03164 1/20 0.69
HIF1A Q16665 1/20 0.69
GSK3B P49841 1/20 0.42
CASP3 P42574 2/20 0.38
CASP7 P55210 2/20 0.38
CASP6 P55212 2/20 0.38
CASP8 Q14790 2/20 0.38
CASP2 P42575 1/20 0.38
TDP1 Q9NUW8 2/20 0.37
ALPL P05186 3/20 0.33

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
Captan SCHEMBL465873 0.86 ALDH1A1 (0.73) ALDH1A1LMNATP53HSD17B10TSHR
Captan SCHEMBL11862934 0.83 ALDH1A1 (1.00) ALDH1A1LMNATP53HSD17B10TSHR
Captan SCHEMBL2121611 0.83 ALDH1A1 (1.00) ALDH1A1LMNATP53HSD17B10TSHR
Captan SCHEMBL11229310 0.83 ALDH1A1 (1.00) ALDH1A1LMNATP53HSD17B10TSHR
Captan SCHEMBL5361742 0.83 ALDH1A1 (1.00) ALDH1A1LMNATP53HSD17B10TSHR
Captan SCHEMBL21047 0.83 ALDH1A1 (1.00) ALDH1A1LMNATP53HSD17B10TSHR
Captan SCHEMBL9314863 0.82 ALDH1A1 (0.96) ALDH1A1LMNATP53HSD17B10TSHR
Captan SCHEMBL1765903 0.82 ALDH1A1 (0.96) ALDH1A1LMNATP53HSD17B10TSHR
Captan SCHEMBL9671681 0.82 ALDH1A1 (0.96) ALDH1A1LMNATP53HSD17B10TSHR
Folpet SCHEMBL11317169 0.78 ALDH1A1 (0.61) ALDH1A1LMNATP53HSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1962593-B1 FUNGICIDAL ACTIVE COMPOUND COMBINATION BAYER CROPSCIENCE AG (DE) 2013-01-23 EP disclosed
US-20090036512-A1 FUNGICIDAL ACTIVE COMPOUND COMBINATION BAYER CROPSCIENCE AG (DE) 2009-02-05 US disclosed
EP-1962593-A1 FUNGICIDAL ACTIVE COMPOUND COMBINATION Bayer CropScience AG (DE) 2008-09-03 EP disclosed
WO-2007068367-A1 FUNGICIDAL ACTIVE COMPOUND COMBINATION BAYER CROPSCIENCE AG (DE) 2007-06-21 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-20090036512-A1 FUNGICIDAL ACTIVE COMPOUND COMBINATION CYP51A1, CAT, CYP3A7 ALDH1A1 1508/4885LMNA 2548/4885TP53 4283/4885

“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.