SCHEMBL5727428

SCHEMBL5727428

Cn1nc(-c2c(F)cccc2F)nc1-c1csc(-c2ccc(OC(F)(F)F)cc2)c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 3/20 0.43
TYK2 P29597 1/20 0.35
HSD17B2 P37059 1/20 0.35
SCN5A Q14524 3/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALPI P09923 1/20 0.34
SCN10A Q9Y5Y9 1/20 0.34
TRPV4 Q9HBA0 1/20 0.34
ACP1 P24666 1/20 0.34
GRM5 P41594 1/20 0.34
ABL1 P00519 1/20 0.33
KIT P10721 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
F2RL3 Q96RI0 1/20 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
SCHEMBL5726584 0.93 TDP2 (0.40) TDP2SCN5ANPSR1SCN10ANR1H2
SCHEMBL5727700 0.86 TDP2 (0.40) TDP2HSD17B2NPSR1GRM5NPC1
SCHEMBL4613467 0.85 TDP2 (0.46) TDP2TYK2HSD17B2SCN5ATRPV4
SCHEMBL5727468 0.84 PTGES (0.40) TDP2SCN5AGRM5KIT
SCHEMBL5727234 0.81 TDP2 (0.41) TDP2TYK2SCN5AALPISCN10A
SCHEMBL5726585 0.80 KDM4E (0.45) TDP2HSD17B2NPSR1NR1H2NR1H3
SCHEMBL5727578 0.79 SMN1; SMN2 (0.38) TDP2NPC1RAB9ANR1H2NR1H3
SCHEMBL5728721 0.77 TDP2 (0.40) TDP2SCN5ANPSR1ALPISCN10A
SCHEMBL5727209 0.77 MAPT (0.42) TDP2NPSR1KITNPC1RAB9A
SCHEMBL8300243 0.77 PTGES (0.41) TDP2SCN5ASCN10AABL1NR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1425278-B1 INSECTICIDAL 3-(2,6-DISUBSTITUTED PHENYL)-5- 4- OR 5-ARYLTHIEN-2- OR -3-YL|-1,2,4-TRIAZOLES DOW AGROSCIENCES LLC (US) 2006-12-20 EP disclosed
US-7056940-B2 Insecticidal 3-(2,6-disubstituted phenyl)-5-[5-arylthien-2-yl]-1,2,4-triazoles DOW AGROSCIENCES LLC (US) 2006-06-06 US disclosed
US-6949576-B2 Insecticidal 3-(2,6-disubstituted phenyl)-5-[5-arylthien-3-yl]-1,2,4-triazoles DOW AGROSCIENCES LLC (US) 2005-09-27 US disclosed
US-20040171661-A1 Insecticidal 3-(2,6-disubstituted phenyl)-5-[5-arylthien-2-yl]-1,2,4-triazoles HEGDE VIDYADHAR BABU (US) 2004-09-02 US disclosed
US-6770665-B2 TRIAZOLE COMPOUNDS HAVING A 2,6-DISUBSTITUTED-PHENYL GROUP IN THE 3-POSITION, ARYLTHIEN-2- OR -3-YL IN THE 5-POSITION AND AN ALKYL GROUP IN THE 1-POSITION ARE EFFECTIVE IN CONTROLLING LEPIDOPTERA, COLEOPTERA, MITES AND OTHER SUCKING PESTS. DOW AGROSCIENCES LLC 2004-08-03 US disclosed
US-20040072887-A1 Insecticidal 3-(2,6-disubstituted phenyl)-5-[5-arylthien-3-yl]-1,2,4-triazoles HEGDE VIDYADHAR BABU (US) 2004-04-15 US disclosed
US-20030134748-A1 Insecticial 3-(2,6-disubstituted phenyl)-5-[4- or 5-arylthien-2- or -3-yl]-1,2,4-triazoles DOW AGROSCIENCES LLC 2003-07-17 US 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 (3 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-20040171661-A1 Insecticidal 3-(2,6-disubstituted phenyl)-5-[5-arylthien-2-yl]-1,2,4-triazoles L3MBTL3, API5, L3MBTL4 TDP2 2312/4885TYK2 1577/4885HSD17B2 3715/4885
US-20040072887-A1 Insecticidal 3-(2,6-disubstituted phenyl)-5-[5-arylthien-3-yl]-1,2,4-triazoles L3MBTL3, API5, L3MBTL4 TDP2 2641/4885TYK2 1710/4885HSD17B2 3781/4885
US-20030134748-A1 Insecticial 3-(2,6-disubstituted phenyl)-5-[4- or 5-arylthien-2- or -3-yl]-1,2,4-triazoles L3MBTL3, API5, L3MBTL4 TDP2 2308/4885TYK2 1427/4885HSD17B2 3826/4885

“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.