SCHEMBL20636720

SCHEMBL20636720

CCOC(=O)c1nn2ccc(C(F)(F)F)cc2c1I

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
KDM4E B2RXH2 2/20 0.41
ADORA1 P30542 2/20 0.41
APP P05067 1/20 0.41
CACNA1B Q00975 1/20 0.39
APBA1 Q02410 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ELANE P08246 3/20 0.39
GRM5 P41594 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ADORA3 P0DMS8 1/20 0.38

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
SCHEMBL20636702 0.83 MAPT (0.39) MAPTKDM4EADORA1APPCACNA1B
SCHEMBL25259109 0.83 MAPT (0.39) MAPTKDM4EADORA1APPCACNA1B
SCHEMBL19538707 0.81 ALOX5 (0.44) MAPTKDM4EGRM5MEN1KMT2A
SCHEMBL18366361 0.81 CACNA1B (0.47) MAPTKDM4EADORA1APPCACNA1B
SCHEMBL29756422 0.77 ELANE (0.51) KDM4EELANEALDH1A1GAA
SCHEMBL18366192 0.76 MAPT (0.46) MAPTADORA1APPCACNA1BAPBA1
SCHEMBL3087139 0.76 SMN1; SMN2 (0.50) MAPTKDM4EALDH1A1GAAL3MBTL1
SCHEMBL20636709 0.74 KDM4E (0.50) MAPTKDM4EADORA1APPGRM5
SCHEMBL19514043 0.74 ALDH1A1 (0.38) MAPTKDM4EGRM5MEN1KMT2A
SCHEMBL19711960 0.74 PDE4A (0.50) MAPTKDM4EADORA1APPCACNA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230348496-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA CROP PROTECTION AG (CH) 2023-11-02 US disclosed
US-20230348496-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA CROP PROTECTION AG (CH) 2023-11-02 US disclosed
US-20230348496-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA CROP PROTECTION AG (CH) 2023-11-02 US disclosed
US-20230303565-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA CROP PROTECTION AG (CH) 2023-09-28 US disclosed
US-20230303565-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA CROP PROTECTION AG (CH) 2023-09-28 US disclosed
US-20230303565-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA CROP PROTECTION AG (CH) 2023-09-28 US disclosed
EP-4208463-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS Syngenta Crop Protection AG (CH) 2023-07-12 EP disclosed
EP-4208464-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS Syngenta Crop Protection AG (CH) 2023-07-12 EP disclosed
WO-2022049144-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA CROP PROTECTION AG (CH) 2022-03-10 WO disclosed
WO-2022049141-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA CROP PROTECTION AG (CH) 2022-03-10 WO disclosed
US-10759815-B2 Condensed heterocyclic compounds and pesticides NISSAN CHEMICAL CORPORATION (JP) 2020-09-01 US disclosed
US-20200223868-A1 CONDENSED HETEROCLYCLIC COMPOUNDS AND PESTICIDES NISSAN CHEMICAL CORPORATION (JP) 2020-07-16 US disclosed
US-10640518-B2 Condensed heterocyclic compounds and pesticides NISSAN CHEMICAL CORPORATION (JP) 2020-05-05 US disclosed
US-20200095263-A1 CONDENSED HETEROCYCLIC COMPOUNDS AND PESTICIDES NISSAN CHEMICAL CORPORATION (JP) 2020-03-26 US disclosed
US-10544163-B2 Condensed heterocyclic compounds and pesticides NISSAN CHEMICAL CORPORATION (JP) 2020-01-28 US disclosed
EP-3428166-A1 CONDENSED HETEROCYCLIC COMPOUND AND PEST CONTROL AGENT Nissan Chemical Corporation (JP) 2019-01-16 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 (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-10759815-B2 Condensed heterocyclic compounds and pesticides NR4A1, CHRM1, NR1D2 MAPT 4246/4885KDM4E 3067/4885ADORA1 283/4885
US-20230303565-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS GSTA1, QSOX1, ACAA2 MAPT 3604/4885KDM4E 2898/4885ADORA1 1962/4885
US-20200223868-A1 CONDENSED HETEROCLYCLIC COMPOUNDS AND PESTICIDES CHRM1, HCRTR1, NR4A1 MAPT 4654/4885KDM4E 3647/4885ADORA1 200/4885
US-10544163-B2 Condensed heterocyclic compounds and pesticides NR4A1, CHRM1, NR1D2 MAPT 4265/4885KDM4E 3163/4885ADORA1 305/4885
US-20230348496-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS FOXM1, GLRX3, ACHE MAPT 3950/4885KDM4E 2896/4885ADORA1 1036/4885
US-20200095263-A1 CONDENSED HETEROCYCLIC COMPOUNDS AND PESTICIDES NR4A1, CHRM1, NR1D2 MAPT 4265/4885KDM4E 3163/4885ADORA1 305/4885
US-10640518-B2 Condensed heterocyclic compounds and pesticides NR4A1, CHRM1, NR1D2 MAPT 4225/4885KDM4E 3056/4885ADORA1 284/4885

“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.