SCHEMBL6074574

SCHEMBL6074574

Cc1c(-c2ccc(O)cc2)csc1-c1nc(-c2c(F)cccc2Cl)nn1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B2 P37059 1/20 0.36
IL2 P60568 1/20 0.33
EIF4E P06730 1/20 0.33
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
KDM4C Q9H3R0 1/20 0.32
ESR1 P03372 3/20 0.32
TRPM8 Q7Z2W7 1/20 0.31
LMNA P02545 2/20 0.31
TP53 P04637 1/20 0.31
THRB P10828 1/20 0.31
KMT2A Q03164 3/20 0.31
MDM4 O15151 1/20 0.31
MAPT P10636 1/20 0.31
MDM2 Q00987 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
POLB P06746 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPK14 Q16539 1/20 0.31
GAA P10253 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
SCHEMBL5727617 0.92 HSD17B2 (0.36) HSD17B2IL2EIF4ENR1H2NR1H3
SCHEMBL5727483 0.89 ALDH1A1 (0.34) IL2EIF4ENR1H2NR1H3KMT2A
SCHEMBL5726859 0.88 KDM4E (0.41) NR1H2NR1H3TP53MAPTSMN1; SMN2
SCHEMBL5726399 0.88 HSD17B2 (0.36) HSD17B2EIF4ENR1H2NR1H3KDM4C
SCHEMBL5727153 0.86 TDP2 (0.39) NR1H2NR1H3TRPM8
SCHEMBL5727056 0.86 SMN1; SMN2 (0.35) LMNATP53THRBKMT2AMAPT
SCHEMBL5726437 0.85 IL2 (0.30) IL2EIF4E
SCHEMBL6976749 0.84 PDE2A (0.35) NR1H2NR1H3LMNATP53THRB
SCHEMBL8942970 0.84 HSD17B2 (0.50) HSD17B2NR1H2NR1H3KDM4CESR1
SCHEMBL5726682 0.84 NR1H2 (0.34) EIF4ENR1H2NR1H3KDM4CLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 HSD17B2 3715/4885IL2 4170/4885EIF4E 1738/4885
US-20040072887-A1 Insecticidal 3-(2,6-disubstituted phenyl)-5-[5-arylthien-3-yl]-1,2,4-triazoles L3MBTL3, API5, L3MBTL4 HSD17B2 3781/4885IL2 4324/4885EIF4E 1739/4885
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 HSD17B2 3826/4885IL2 4030/4885EIF4E 2202/4885

“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.