SCHEMBL21061

SCHEMBL21061

Cc1cc(Cl)n(C)n1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL14128272 1.00
Formaldehyde SCHEMBL27838123 0.93 MEN1 (0.40)
SCHEMBL27861243 0.89 MEN1 (0.38)
SCHEMBL30456784 0.83
SCHEMBL16487535 0.72 SMN1; SMN2 (0.42)
SCHEMBL147208 0.72
SCHEMBL25087089 0.72
SCHEMBL22719968 0.72
SCHEMBL19224193 0.72
SCHEMBL1066584 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4359368-A1 COMBINATION OF A PYRAZOLE AND A THIOPHOSPHORIC TRIAMIDE WockLab GmbH & Co. KG (DE) 2024-05-01 EP claimed
US-11919839-B2 Alpha-cinnamide compounds and compositions as HDAC8 inhibitors VALO HEALTH, INC. (US) 2024-03-05 US claimed
WO-2022268777-A1 COMBINATION OF A PYRAZOLE AND A THIOPHOSPHORIC TRIAMIDE WOCKLAB GMBH & CO. KG (DE) 2022-12-29 WO claimed
CN-114634456-A 5-nitroimino-4H-1, 2, 4-triazole compound and preparation method and application thereof 赣南师范大学 2022-06-17 CN claimed
US-20220073452-A1 ALPHA-CINNAMIDE COMPOUNDS AND COMPOSITIONS AS HDAC8 INHIBITORS VALO HEALTH, INC. 2022-03-10 US claimed
CN-103613583-A 1, 3-substituent-4-substituted pyrazol acylhydrazone derivative and preparation method and application thereof UNIV GUIZHOU 2014-03-05 CN claimed
EP-0294238-B1 NOVEL 1-ALKYL-1-SULFONYL-2-ALKOXYCARBONYLSULFENYLHYDRAZINES HAVING ANTINEOPLASTIC ACTIVITY YALE UNIVERSITY (US) 1992-08-26 EP claimed
US-4962114-A ANTITUMOR AGENTS; ALKYLATING AGENTS; NONTOXIC YALE UNIVERSITY (US) 1990-10-09 US claimed
EP-0294238-A1 Novel 1-alkyl-1-sulfonyl-2-alkoxycarbonylsulfenylhydrazines having antineoplastic activity YALE UNIVERSITY (US) 1988-12-07 EP claimed
EP-3351533-B1 BIARYL DERIVATIVE AND MEDICINE CONTAINING SAME KAKEN PHARMA CO LTD (JP) 2025-07-23 EP disclosed
CN-118878529-A 2, 3-Dihydro-oxazole compound containing 1, 3-dithiane and preparation method thereof 兰州大学 2024-11-01 CN disclosed
US-RE50082-E1 (5,6-dihydro)pyrimido[4,5-e]indolizines NETHERLANDS TRANSLATIONAL RESEARCH CENTER B.V. (NL) 2024-08-20 US disclosed
US-20240228472-A1 HETEROCYCLIC COMPOUND AND HARMFUL-ARTHROPOD-CONTROLLING COMPOSITION CONTAINING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2024-07-11 US disclosed
US-20240228472-A1 HETEROCYCLIC COMPOUND AND HARMFUL-ARTHROPOD-CONTROLLING COMPOSITION CONTAINING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2024-07-11 US disclosed
EP-0087780-A2 Pyrazolesulfonylurea derivative, preparation thereof, herbicide containing said derivative as active ingredient and herbicidal method by use thereof NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1983-09-07 EP disclosed
US-4301293-A Herbicidal compositions and pyrazole derivatives SANKYO COMPANY LTD. (JP) 1981-11-17 US disclosed
US-4261729-A Herbicidal compositions and pyrazole derivatives SANKYO COMPANY LIMITED (JP) 1981-04-14 US disclosed
US-4146726-A HERBICIDES SANKYO COMPANY LIMITED (JP) 1979-03-27 US disclosed
US-4077956-A ANTIINFLAMMATORY, IMMUNOSUPPRESSIVE E. R. SQUIBB & SONS, INC. (US) 1978-03-07 US disclosed
US-4063925-A Herbicidal compositions SANKYO COMPANY LIMITED (JA) 1977-12-20 US disclosed