SCHEMBL5352877

SCHEMBL5352877

CSCCCCCCCN=C=S

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 8/20 1.00
NAAA Q02083 5/20 0.58
MIF P14174 4/20 0.52
GSK3B P49841 1/20 0.48
KEAP1 Q14145 2/20 0.45
NFE2L2 Q16236 2/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
TP53 P04637 1/20 0.45
BACH1 O14867 1/20 0.45
MAFK O60675 1/20 0.45
EGFR P00533 1/20 0.45
PTGS2 P35354 1/20 0.45

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
SCHEMBL25332310 1.00 TRPA1 (1.00) TRPA1NAAAMIFGSK3BKEAP1
SCHEMBL3115548 1.00 TRPA1 (1.00) TRPA1NAAAMIFGSK3BKEAP1
SCHEMBL1020887 1.00 TRPA1 (1.00) TRPA1NAAAMIFGSK3BKEAP1
SCHEMBL3123984 1.00 TRPA1 (1.00) TRPA1NAAAMIFGSK3BKEAP1
SCHEMBL2679812 1.00 TRPA1 (1.00) TRPA1NAAAMIFGSK3BKEAP1
Erucin SCHEMBL435774 0.98
SCHEMBL668271 0.91
SCHEMBL331092 0.81 TRPA1 (0.68) TRPA1NAAAMIFGSK3BKEAP1
Erucin SCHEMBL7579439 0.80 TRPA1 (0.68) TRPA1NAAAMIFGSK3BKEAP1
SCHEMBL10585683 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4580612-A1 USE OF NRF2 ACTIVATORS FOR THE TREATMENT OF CEREBRAL SMALL VESSEL DISEASE Institut National de la Santé et de la Recherche Médicale (FR) 2025-07-09 EP claimed
WO-2024047248-A1 USE OF NRF2 ACTIVATORS FOR THE TREATMENT OF CEREBRAL SMALL VESSEL DISEASE Institut National de la Santé et de la Recherche Médicale (FR) 2024-03-07 WO claimed
US-20210069159-A1 Bach1 Inhibitors in Combination with Nrf2 Activators and Pharmaceutical Compositions Thereof VTV THERAPEUTICS LLC 2021-03-11 US claimed
US-10898475-B2 Bach1 inhibitors in combination with Nrf2 activators and pharmaceutical compositions thereof VTV THERAPEUTICS LLC (US) 2021-01-26 US claimed
US-20170231967-A1 Bach1 Inhibitors in Combination with Nrf2 Activators and Pharmaceutical Compositions Thereof VTV THERAPEUTICS LLC 2017-08-17 US claimed
WO-2016089648-A1 BACH 1 INHIBITORS IN COMBINATION WITH NRF2 ACTIVATORS AND PHARMACEUTICAL COMPOSITIONS THEREOF VTV THERAPEUTICS LLC (US) 2016-06-09 WO claimed
US-7232583-B2 Method for preparing isothiocyanate(s) from cruciferous plant material KINJIRUSHI CO., LTD. (JP) 2007-06-19 US claimed
US-20030064131-A1 Method for preparing isothiocyanate(s) from cruciferous plant material JAPANESE R AND D ASSOC. FOR NEW FUNCTIONAL FOODS (JP) 2003-04-03 US claimed
EP-4746880-A2 METHODS OF TREATING DILATED CARDIOMYOPATHY Regencor, Inc. (US) 2026-05-27 EP disclosed
US-20260034107-A1 SUBSTITUTED FUSED IMIDAZOLE DERIVATIVES AND METHODS OF TREATING SICKLE CELL DISEASE AND RELATED COMPLICATIONS VTV THERAPEUTICS LLC (US) 2026-02-05 US disclosed
EP-4580612-A1 USE OF NRF2 ACTIVATORS FOR THE TREATMENT OF CEREBRAL SMALL VESSEL DISEASE Institut National de la Santé et de la Recherche Médicale (FR) 2025-07-09 EP disclosed
CN-119632035-A Tonsillitis and isothiocyanate compound insecticidal composition, preparation and application thereof 西北农林科技大学 2025-03-18 CN disclosed
US-20250066293-A1 OIL-BASED ISOTHIOCYANATE PRODUCTS AND PROCESSES FOR PREPARING OIL-BASED ISOTHIOCYANATE PRODUCTS BRASSICA PROTECTION PRODUCTS LLC (US) 2025-02-27 US disclosed
WO-2025024320-A2 METHODS OF TREATING DILATED CARDIOMYOPATHY REGENCOR, INC. (US) 2025-01-30 WO disclosed
US-20130028992-A1 Herbal-Based Solution for Treating Symptoms of Nasal Conditions WALKER CALEB JAMES (US) 2013-01-31 US disclosed
US-7232583-B2 Method for preparing isothiocyanate(s) from cruciferous plant material KINJIRUSHI CO., LTD. (JP) 2007-06-19 US disclosed
CN-1290522-C Immunity regulating medicine TAIQING SICHUAN FOOD CO LTD (CN) 2006-12-20 CN disclosed
CN-1593578-A Immunity regulating medicine TAIQING SICHUAN FOOD CO LTD (CN) 2005-03-16 CN disclosed
US-20040096528-A1 Compositions and methods for preserving personal care products UNICITY INTERNATIONAL, INC. 2004-05-20 US disclosed
US-20030064131-A1 Method for preparing isothiocyanate(s) from cruciferous plant material JAPANESE R AND D ASSOC. FOR NEW FUNCTIONAL FOODS (JP) 2003-04-03 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 (4 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-20170231967-A1 Bach1 Inhibitors in Combination with Nrf2 Activators and Pharmaceutical Compositions Thereof BACH1, KEAP1, NFE2L2 TRPA1 2865/4885NAAA 4201/4885MIF 1537/4885
US-10898475-B2 Bach1 inhibitors in combination with Nrf2 activators and pharmaceutical compositions thereof BACH1, KEAP1, NFE2L2 TRPA1 4407/4885NAAA 3867/4885MIF 1739/4885
US-20260034107-A1 SUBSTITUTED FUSED IMIDAZOLE DERIVATIVES AND METHODS OF TREATING SICKLE CELL DISEASE AND RELATED COMPLICATIONS HBB, HBZ, HBG1 TRPA1 2056/4885NAAA 4212/4885MIF 2915/4885
US-20210069159-A1 Bach1 Inhibitors in Combination with Nrf2 Activators and Pharmaceutical Compositions Thereof BACH1, KEAP1, NFE2L2 TRPA1 3653/4885NAAA 4268/4885MIF 1721/4885

“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.