SCHEMBL5487808

SCHEMBL5487808

CCC(I)CCC(=O)O

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
SCHEMBL14302594 1.00
SCHEMBL9503709 0.86 AKR1B1 (0.46)
SCHEMBL15088446 0.78
SCHEMBL8141398 0.75
SCHEMBL9690464 0.74
SCHEMBL1421121 0.74
SCHEMBL1009649 0.74 GABRP (0.50)
SCHEMBL1235578 0.74 GABRP (0.56)
SCHEMBL13095885 0.74 GABRP (0.50)
SCHEMBL25490353 0.73 GABRP (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6100373-A Functionalized diene monomers and polymers containing functionalized dienes and methods for their preparation IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2000-08-08 US claimed
EP-1204649-B1 ARYLMETHYL-CARBONYLAMINO-THIAZOLE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS PFIZER ITALIA SRL (IT) 2007-10-17 EP disclosed
US-20050004120-A1 Arylmethyl-carbonylamino-thiazole derivatives and their use as antitumor agents PHARMACIA ITALIS S.P.A. (IT) 2005-01-06 US disclosed
US-6784198-B1 2-(ARYLMETHYL-CARBONYLAMINO)-1,3-THIAZOLE DERIVATIVES; CDK/CYCLIN KINASE INHIBITORY ACTIVITY PHARMACIA ITALIA S.P.A. (IT) 2004-08-31 US disclosed
US-6583260-B2 Such as 2-(N,N-dimethylaminomethyl)-1,3- butadiene); for use in adhesives, sealants, surfactants, elastomers, ionomers, coatings and membranes IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2003-06-24 US disclosed
US-20020151673-A1 Functionalized diene monomers and polymers containing functionalized dienes and methods for their preparation SHEARES VALERIE V (US) 2002-10-17 US disclosed
EP-1204649-A1 ARYLMETHYL-CARBONYLAMINO-THIAZOLE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS Pharmacia Italia S.p.A. (IT) 2002-05-15 EP disclosed
US-6344538-B1 REACTION OF 3-BROMOMETHYL-2,5-HYDROTHIOPHENE-1,1-DIOXIDE WITH NUCLEOPHILE WITH AMINE, HYDROXY, CARBOXY ACID, ESTER OR NITRILE IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2002-02-05 US disclosed
WO-2001014353-A1 ARYLMETHYL-CARBONYLAMINO-THIAZOLE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA, S.P.A. (IT) 2001-03-01 WO disclosed
EP-0623132-B1 DISUBSTITUTED POLYCYCLIC SYSTEMS AS COGNITION ENHANCERS DU PONT PHARM CO (US) 2000-08-09 EP disclosed
CN-1012500-B Process for preparing aryl hydroxamates SQUIBB & SONS INC (US) 1991-05-01 CN disclosed
US-4962203-A ANTIASTHMATIC, ANTIALLERGENIC, ANTIINFLAMMATORY AND CYTOPROTECTIVE AGENTS MERCK FROST CANADA, INC. (CA) 1990-10-09 US disclosed
EP-0206751-A2 2-Substituted quinolines, their preparation and use MERCK FROSST CANADA INC. (CA) 1986-12-30 EP disclosed
EP-0200377-A2 Hydroxamates E.R. Squibb &amp; Sons, Inc. (US) 1986-11-05 EP disclosed
CN-85104470-A The method for preparing arythydroxamtes 1986-10-01 CN disclosed
US-4607053-A L2POXYGENASE INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1986-08-19 US disclosed
US-4604407-A Hydroxamates E. R. SQUIBB & SONS, INC. (US) 1986-08-05 US disclosed
EP-0161939-A2 Arylhydroxamates E.R. Squibb &amp; Sons, Inc. (US) 1985-11-21 EP disclosed
US-4275160-A Imipramine derivatives and poly(amino acid) conjugates SYVA COMPANY (US) 1981-06-23 US disclosed
US-4060540-A BRONCHODILATORS, HYPOTENSIVE, ANTIULCER AMERICAN CYANAMID COMPANY (US) 1977-11-29 US disclosed