Sugi Predict

Sugi Predict / Compounds / SCHEMBL156805

SCHEMBL156805

SCHEMBL156805

CC#CC(C)(C)NC(=O)C(Oc1ccc2ncc(Br)cc2c1)SC

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.34
▸ F2 P00734 1/20 0.34
▸ GLA P06280 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ ALPL P05186 1/20 0.32
▸ MALT1 Q9UDY8 1/20 0.32
▸ FFAR1 O14842 1/20 0.31
▸ HPGDS O60760 1/20 0.31
▸ ACACB O00763 1/20 0.31
▸ MET P08581 1/20 0.31
▸ PDE3B Q13370 1/20 0.30
▸ PDE3A Q14432 1/20 0.30
▸ SCN9A Q15858 1/20 0.30
▸ HDAC8 Q9BY41 1/20 0.30
▸ SLC2A1 P11166 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
SCHEMBL29814974 1.00 ALDH1A1 (0.34) ALDH1A1F2GLAHPGDALPL
SCHEMBL12181895 0.89 ALDH1A1 (0.45) ALDH1A1F2GLAHPGDALPL
SCHEMBL14860059 0.89 ALDH1A1 (0.35) ALDH1A1F2GLAHPGDHPGDS
SCHEMBL633389 0.89 HPGDS (0.38) ALDH1A1F2GLAHPGDALPL
SCHEMBL3739362 0.87 ALDH1A1 (0.34) ALDH1A1F2GLAHPGDHPGDS
SCHEMBL534860 0.87 SCN9A (0.37) ALDH1A1F2GLAHPGDALPL
SCHEMBL14859789 0.86 PDE10A (0.34) ALDH1A1F2GLAHPGDMET
SCHEMBL157007 0.86 ALDH1A1 (0.33) ALDH1A1F2GLAHPGDHPGDS
SCHEMBL13044069 0.85 — —
SCHEMBL534656 0.85 ALDH1A1 (0.35) ALDH1A1F2GLAHPGDALPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180310562-A1 FUNGICIDAL PYRAZOLE MIXTURES FMC CORP (US) 2018-11-01 — — US claimed
EP-2809157-B1 FUNGICIDAL PYRAZOLE MIXTURES DU PONT (US) 2017-09-06 — — EP claimed
WO-2015157005-A1 SUBSTITUTED TOLYL FUNGICIDE MIXTURES E I DU PONT DE NEMOURS AND COMPANY (US) 2015-10-15 — — WO claimed
US-20150266850-A1 SUBSTITUTED TOLYL FUNGICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2015-09-24 — — US claimed
EP-2809157-A2 FUNGICIDAL PYRAZOLE MIXTURES E. I. Du Pont de Nemours and Company (US) 2014-12-10 — — EP claimed
WO-2014130409-A2 FUNGICIDAL PYRAZOLE MIXTURES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2014-08-28 — — WO claimed
WO-2013116251-A2 FUNGICIDAL PYRAZOLE MIXTURES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2013-08-08 — — WO claimed
US-12606548-B2 Fungicidal oxadiazoles FMC CORPORATION (US) 2026-04-21 — — US disclosed
US-12398107-B2 Fungicidal nitroanilino substituted pyrazoles FMC CORPORATION (US) 2025-08-26 — — US disclosed
US-20240324596-A1 SUBSTITUTED TOLYL FUNGICIDES FMC CORPORATION 2024-10-03 — — US disclosed
EP-4388876-A2 FUNGICIDAL NITROANILINO SUBSTITUTED PYRAZOLES FMC Corporation (US) 2024-06-26 — — EP disclosed
CN-112969688-B Fungicidal nitroaniline-substituted pyrazoles FMC公司 2024-06-04 — — CN disclosed
US-20240166638-A1 FUNGICIDAL OXADIAZOLES FMC CORP (US) 2024-05-23 — — US disclosed
EP-2809157-A2 FUNGICIDAL PYRAZOLE MIXTURES E. I. Du Pont de Nemours and Company (US) 2014-12-10 — — EP disclosed
WO-2014130409-A2 FUNGICIDAL PYRAZOLE MIXTURES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2014-08-28 — — WO disclosed
WO-2013126283-A1 FUNGICIDAL PYRAZOLES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2013-08-29 — — WO disclosed
WO-2013116251-A2 FUNGICIDAL PYRAZOLE MIXTURES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2013-08-08 — — WO disclosed
EP-2611296-A2 FUNGICIDAL PYRAZOLES AND THEIR MIXTURES E.I. Du Pont De Nemours And Company (US) 2013-07-10 — — EP disclosed
US-20130129839-A1 FUNGICIDAL PYRAZOLES AND THEIR MIXTURES E I DU PONT DE NEMOURS AND COMPANY (US) 2013-05-23 — — US disclosed
WO-2012031061-A2 FUNGICIDAL PYRAZOLES AND THEIR MIXTURES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-03-08 — — 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 (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-20130129839-A1 FUNGICIDAL PYRAZOLES AND THEIR MIXTURES CYP1B1, NOX3, NOX1 ALDH1A1 1167/4885F2 484/4885GLA 4218/4885
US-20150266850-A1 SUBSTITUTED TOLYL FUNGICIDES TH, CYP1B1, CYP1A1 ALDH1A1 544/4885F2 4121/4885GLA 2980/4885
US-20240166638-A1 FUNGICIDAL OXADIAZOLES OXA1L, NOX1, TH ALDH1A1 603/4885F2 941/4885GLA 3736/4885
US-20240324596-A1 SUBSTITUTED TOLYL FUNGICIDES TH, NAT1, CYP1B1 ALDH1A1 1104/4885F2 2777/4885GLA 3056/4885
US-12398107-B2 Fungicidal nitroanilino substituted pyrazoles TH, NOX1, NOX3 ALDH1A1 1766/4885F2 422/4885GLA 4382/4885
US-12606548-B2 Fungicidal oxadiazoles AOC2, AOC3, MT-CO3 ALDH1A1 2861/4885F2 3132/4885GLA 4663/4885
US-20180310562-A1 FUNGICIDAL PYRAZOLE MIXTURES CYP1B1, CBR3, CBR1 ALDH1A1 526/4885F2 360/4885GLA 3336/4885

“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.