SCHEMBL301866

SCHEMBL301866

O=C(Cl)c1ccc(Br)o1

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
SCHEMBL1355720 0.82 MAPT (0.39)
SCHEMBL27623978 0.80 ALDH1A1 (0.57)
SCHEMBL216529 0.78
SCHEMBL11274940 0.78
SCHEMBL1674254 0.76
SCHEMBL220742 0.76
Hydrochloric Acid SCHEMBL10707936 0.76 ALDH1A1 (0.53)
SCHEMBL31462930 0.75 ALDH1A1 (0.42)
Hydrochloric Acid SCHEMBL28750266 0.74 ALDH1A1 (0.53)
SCHEMBL5970015 0.74 ALDH1A1 (0.57)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4851440-B2 2012-01-11 JP claimed
CN-101429194-B Process for the preparation of tryptase inhibitors AVENTIS PHARMACEUTICALS, INC. (US) 2011-12-14 CN claimed
EP-1723140-B1 PROCESS FOR THE PREPARATION OF TRYPTASE INHIBITORS AVENTIS PHARMA INC (US) 2009-11-04 EP claimed
CN-101429194-A Process for the preparation of tryptase inhibitors AVENTIS PHARMA INC (US) 2009-05-13 CN claimed
US-20070197597-A1 Process for the preparation of tryptase inhibitors SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-08-23 US claimed
CN-1950362-A Preparation method of tryptase inhibitor AVENTIS PHARMA INC (US) 2007-04-18 CN claimed
EP-1723140-A1 PROCESS FOR THE PREPARATION OF TRYPTASE INHIBITORS Aventis Pharmaceuticals Inc. (US) 2006-11-22 EP claimed
WO-2005095385-A1 PROCESS FOR THE PREPARATION OF TRYPTASE INHIBITORS AVENTIS PHARMACEUTICALS INC. (US) 2005-10-13 WO claimed
EP-1571150-A1 Process for the preparation of tryptase inhibitors Aventis Pharma Deutschland GmbH (DE) 2005-09-07 EP claimed
EP-0440329-A1 S-substituted carbonyl substituted betathioacrylamide biocides and fungicides ROHM AND HAAS COMPANY (US) 1991-08-07 EP claimed
CN-115626918-B Phenyl furan-tetrahydroisoquinoline compound and preparation and application thereof 浙江工业大学 2024-11-05 CN disclosed
WO-2023202583-A1 FXR REGULATOR AND USE THEREOF 北京大学 2023-10-26 WO disclosed
CN-116903559-A FXR modulators and uses thereof 北京大学 2023-10-20 CN disclosed
CN-115626918-A Phenyl furan-tetrahydroisoquinoline compound and preparation and application thereof 浙江工业大学 2023-01-20 CN disclosed
CN-112552290-B Amido bond-containing phenylfuran-2-tetrahydroisoquinoline compound and preparation method and application thereof 浙江工业大学 2022-10-11 CN disclosed
US-4344943-A ANALGESICS, ANTIINFLAMMATORY AGENTS SYNTEX (U.S.A.) INC. (US) 1982-08-17 US disclosed
EP-0057401-A1 Aromatic heterocyclic esters of steroids, their preparation and pharmaceutical compositions containing them SCHERING CORPORATION (US) 1982-08-11 EP disclosed
US-4298616-A FOR APPLICATION TO PLANTS OR SEEDS IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1981-11-03 US disclosed
EP-0028465-A1 Acylanilide compounds, methods for their preparation, compositions containing them, and processes for combatting fungi IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1981-05-13 EP disclosed
US-3982922-A Herbicidal compositions containing furancarboxamides VELSICOL CHEMICAL CORPORATION (US) 1976-09-28 US disclosed