SCHEMBL22716

SCHEMBL22716

[O]C1CCCC1

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
SCHEMBL812318 0.95 CES2 (0.39)
SCHEMBL102554 0.95
SCHEMBL303428 0.95 CES2 (0.39)
SCHEMBL811787 0.95 CES2 (0.39)
SCHEMBL811882 0.95 CES2 (0.39)
SCHEMBL4349287 0.95 CES2 (0.39)
SCHEMBL650716 0.95 CES2 (0.39)
SCHEMBL4644678 0.95 CES2 (0.39)
SCHEMBL653884 0.95 CES2 (0.39)
SCHEMBL811993 0.95 CES2 (0.39)

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 34447 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024146619-A1 AURONE DERIVATIVE OR ANALOG, AND PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF 中国科学院上海药物研究所 2024-07-11 WO claimed
CN-118265696-A Aryl carboxylic acid compound and application thereof in preparation of Mrgpr X &lt; 4 &gt; inhibitor 深圳博瑞医药科技有限公司 2024-06-28 CN claimed
WO-2024132893-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2024-06-27 WO claimed
CN-118221500-A Preparation method of chloro aromatic compound 大连理工大学 2024-06-21 CN claimed
US-20240199542-A1 SUBSTITUTED PYRROLIDIN-2-ONES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2024-06-20 US claimed
WO-2024126806-A1 CROSSLINKERS FOR WATER-BORNE ALKYD RESINS BORCHERS GMBH (DE) 2024-06-20 WO claimed
CN-118206473-A Compound, preparation method thereof and application of compound in preparation of sEH inhibitor and PPARs agonist 沈阳药科大学 2024-06-18 CN claimed
CN-118206542-A Compound, preparation method thereof and application of compound in preparation of sEH inhibitor and PPARs agonist 沈阳药科大学 2024-06-18 CN claimed
CN-118184545-A Compound, preparation method thereof and application of compound in preparation of sEH inhibitor and PPARs agonist 沈阳药科大学 2024-06-14 CN claimed
CN-118184642-A Aromatic ring system heterocycle compound, and pharmaceutical composition and application thereof 中国药科大学 2024-06-14 CN claimed
US-4221807-A ADRENERGIC BLOCKING AGENTS IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1980-09-09 US claimed
US-4211436-A Pressure-sensitive recording material BAYER AKTIENGESELLSCHAFT (DE) 1980-07-08 US claimed
US-4182911-A BETA-ADRENERGIC BLOCKING AGENTS IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1980-01-08 US claimed
US-4171374-A 1-ARYLOXY-3-SUBSTITUTED UREIDO-ALKYLAMINO-2-PROPANOLS, ADRENERGIC BLOCKING AGENTS, CARDIAC STIMULANTS IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1979-10-16 US claimed
EP-0002450-A1 1-N-substituted-4,6-di-O-(aminoglycosyl)-1,3-diamino-cyclitol derivatives, process for preparing them and medicaments containing them BAYER AG (DE) 1979-06-27 EP claimed
US-4141987-A HYPOTENSIVE, ADRENERGIC BLOCKING AGENT IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1979-02-27 US claimed
US-4117117-A TRIDECAPETIDE HAVING GASTRIN EFFECT MAX PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN (DE) 1978-09-26 US claimed
US-4075341-A 2-Substituted phenyl-5-triazols [5,1-a] isoquinoline compounds GRUPPO LEPETIT S.P.A. (IT) 1978-02-21 US claimed
US-3935273-A ANTIINFLAMMATORY, ANALGESIC, ANTIPYRETIC, ANTIPRURITIC SYNTEX CORPORATION (US) 1976-01-27 US claimed
US-3931297-A 10-Hydroxy PGC compounds SYNTEX (U.S.A.) INC. (US) 1976-01-06 US claimed