SCHEMBL61391

SCHEMBL61391

COc1ccc(CS)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 1.00
CA12 O43570 1/20 0.58
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
CA7 P43166 1/20 0.58
CA9 Q16790 1/20 0.58
CA14 Q9ULX7 1/20 0.58
AGXT P21549 2/20 0.54
LTA4H P09960 1/20 0.54
TAAR1 Q96RJ0 1/20 0.54
ALDH1A1 P00352 2/20 0.52
ALOX15 P16050 2/20 0.52
TP53 P04637 1/20 0.52
CYP3A4 P08684 1/20 0.52
TSHR P16473 1/20 0.52
ALOX12 P18054 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
SLC6A4 P31645 1/20 0.50
CALM1 P0DP23 1/20 0.48
HDAC3 O15379 1/20 0.48

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
Hydrochloric Acid SCHEMBL5797444 0.97 IDO1 (0.95) IDO1CA12CA1CA2CA7
SCHEMBL31065947 0.97 IDO1 (0.95) IDO1CA12CA1CA2CA7
SCHEMBL6624908 0.97 IDO1 (0.95) IDO1CA12CA1CA2CA7
SCHEMBL7447876 0.93 IDO1 (0.86) IDO1CA12CA1CA2CA7
Alcohol SCHEMBL6515383 0.91 IDO1 (0.83) IDO1CA12CA1CA2CA7
Potassium Ion SCHEMBL5406677 0.87 IDO1 (0.76) IDO1CA12CA1CA2CA7
SCHEMBL3729725 0.82 IDO1 (0.68) IDO1LTA4HTAAR1
SCHEMBL1255034 0.80 IDO1 (0.67) IDO1CA12CA1CA2CA7
SCHEMBL27884 0.78 LTA4H (0.81) IDO1CA12CA1CA2CA7
SCHEMBL285383 0.78 IDO1 (0.64) IDO1LTA4HALDH1A1CYP3A4TSHR

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

Appears in 2625 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12497365-B2 4-pyridinyl formamide compound or derivative thereof, preparation method therefor, herbicidal composition and use thereof QINGDAO KINGAGROOT CHEMICAL COMPOUND CO., LTD. (CN) 2025-12-16 US claimed
CN-120064645-A SERS probe combination and kit and method for identifying and/or quantifying platelet-adhesive CTC 复旦大学附属中山医院 2025-05-30 CN claimed
CN-120058585-A Dimercapto conjugate of active allyl alcohol acetate, and preparation method and application thereof 南京工业大学 2025-05-30 CN claimed
CN-119613304-A Allicin derivative, preparation method and application 西北大学 2025-03-14 CN claimed
CN-115015310-B Analysis method of sulfhydryl compound 宁波大学 2024-12-10 CN claimed
EP-4370227-A1 EPOXIDE-ACTIVATED SUBSTRATES AND HYDROPHOBIC INTERACTION CHROMATOGRAPHY MEMBRANE MADE THEREFROM Donaldson Company, Inc. (US) 2024-05-22 EP claimed
CN-117915999-A Epoxide-activated substrates and hydrophobic interaction chromatography membranes made therefrom 唐纳森公司 2024-04-19 CN claimed
EP-3892618-B1 4-PYRIDINYL FORMAMIDE COMPOUND OR DERIVATIVE THEREOF, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF QINGDAO KINGAGROOT CHEMICAL COMPOUND CO LTD (CN) 2024-04-10 EP claimed
CN-116789579-A Preparation method of ultrafast metal-free solvent-free disulfide bond-containing compound 南京工业大学 2023-09-22 CN claimed
CN-116554069-A Preparation method and preparation equipment of formate compound 绍兴贝斯美化工股份有限公司 2023-08-08 CN claimed
EP-0289371-B1 IMIDAZOPYRIDINE DERIVATIVES, THEIR PREPARATION AND THERAPEUTICAL USE SYNTHELABO (FR) 1991-09-25 EP claimed
EP-0447171-A2 Polysulfate of cyclodextrin derivative and process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1991-09-18 EP claimed
US-4847263-A SEDATIVES, ANXIOLITIC AGENTS SYNTHELABO (FR) 1989-07-11 US claimed
EP-0167261-B1 PROCESS FOR THE DESULPHURISATION OF MERCAPTANS The British Petroleum Company p.l.c. (GB) 1988-05-04 EP claimed
US-4731370-A VASODILATOR, ANTICOAGULANT TOYAMA CHEMICAL CO., LTD. (JP) 1988-03-15 US claimed
US-4713387-A Vasodilating and platelet aggregation inhibiting 1,4 dihydropyridines with an imidazolyl or pyridyl containing ester TOYAMA CHEMICAL CO., LTD. (JP) 1987-12-15 US claimed
US-4704481-A Process for the desulphurization of mercaptans THE BRITISH PETROLEUM COMPANY P.L.C. (GB) 1987-11-03 US claimed
US-4661619-A TREATMENT OF AROMATIC MERCAPTAN WITH CARBON MONOXIDE AND WATER OR ALCOHOL AND COBALT CARBONYL CATALYST THE BRITISH PETROLEUM COMPANY P.L.C. (GB) 1987-04-28 US claimed
EP-0167261-A1 Process for the desulphurisation of mercaptans The British Petroleum Company p.l.c. (GB) 1986-01-08 EP claimed
WO-1985005354-A1 PROCESS FOR THE DESULPHURISATION OF MERCAPTANS THE BRITISH PETROLEUM COMPANY P.L.C. (GB) 1985-12-05 WO claimed