SCHEMBL307617

SCHEMBL307617

[S]Cc1ccc(Cl)cc1

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
SCHEMBL1145264 0.77 TAAR1 (0.56)
SCHEMBL96193 0.75
SCHEMBL11148221 0.75
SCHEMBL1106684 0.73 IDO1 (0.58)
SCHEMBL2135113 0.73 TAAR1 (0.68)
SCHEMBL27890138 0.73 IDO1 (0.50)
SCHEMBL9168870 0.73 TAAR1 (0.52)
1,4-Dichlorobenzene SCHEMBL27341589 0.71 LMNA (0.80)
SCHEMBL120896 0.71
SCHEMBL7803602 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8877748-B2 Heterocyclic fused anthraquinone derivatives, manufacturing method and pharmaceutical composition using thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2014-11-04 US claimed
US-20130289028-A1 HETEROCYCLIC FUSED ANTHRAQUINONE DERIVATIVES, MANUFACTURING METHOD AND PHARMACEUTICAL COMPOSITION USING THEREOF NATIONAL DEFENSE MEDICAL CENTER (TW) 2013-10-31 US claimed
EP-1699799-B1 CONTROL OF PARASITES IN ANIMALS BY THE USE OF IMIDAZO [1,2-B]PYRIDAZINE DERIVATIVES SCHERING PLOUGH LTD (CH) 2007-05-16 EP claimed
US-20070048637-A1 Arylamine polymer and organic thin film transistor RICOH COMPANY LIMITED (JP) 2007-03-01 US claimed
EP-0937072-B1 THIENYLCYCLOHEXANONE DERIVATIVES AS LIGANDS OF THE GABA A alpha5 RECEPTOR SUBTYPE MERCK SHARP & DOHME (GB) 2002-01-09 EP claimed
EP-0818146-B1 Synergistic herbicides AVENTIS CROPSCIENCE GMBH (DE) 2001-09-19 EP claimed
EP-0447171-B1 Polysulfate of cyclodextrin derivative and process for preparing the same TANABE SEIYAKU CO (JP) 1994-11-02 EP claimed
US-5250520-A Antiretrovirus activity TANABE SEIYAKU CO., LTD. (JP) 1993-10-05 US claimed
EP-0447171-A2 Polysulfate of cyclodextrin derivative and process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1991-09-18 EP claimed
EP-0428849-A2 Retroviral protease inhibitors HOECHST AKTIENGESELLSCHAFT (DE) 1991-05-29 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
EP-0118685-A1 Propene derivatives and their use as plant growth inhibitors DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1984-09-19 EP claimed
EP-0117412-A1 Propene derivatives and their use as plant growth inhibitors DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1984-09-05 EP claimed
US-4380468-A RETARDS AND STABILIZES THIOLCARBAMATES AGAINST SOIL BIODEGRADATION STAUFFER CHEMICAL COMPANY (US) 1983-04-19 US claimed
US-4241056-A ANTIBIOTICS BOEHRINGER INGELHEIM GMBH (DE) 1980-12-23 US claimed
US-3946048-A HERBICIDES BASF AKTIENGESELLSCHAFT (DT) 1976-03-23 US claimed
CN-114653405-A Vase-like polyacid-based three-dimensional metal organic framework material and preparation method and application thereof 许昌学院 2022-06-24 CN disclosed
US-3954732-A BACTERICIDAL PENICILLINS FUJISAWA PHARMACEUTICAL CO., LTD. (JA) 1976-05-04 US disclosed
US-3946048-A HERBICIDES BASF AKTIENGESELLSCHAFT (DT) 1976-03-23 US disclosed