SCHEMBL2137941

SCHEMBL2137941

O=C(C(Cl)Cl)N1CCCC12CCCC2

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
SCHEMBL30893978 0.73 HCRTR1 (0.31)
SCHEMBL11403724 0.72 CTSB (0.31)
SCHEMBL31751854 0.71 LTA4H (0.34)
SCHEMBL9873835 0.71 CTSB (0.32)
SCHEMBL9874551 0.71 CTSB (0.32)
SCHEMBL26926486 0.70 TSHR (0.33)
SCHEMBL15007869 0.70
SCHEMBL9873974 0.69 ALDH1A1 (0.36)
SCHEMBL11384739 0.69 ADRA2C (0.38)
SCHEMBL29998084 0.69 HCRTR1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7902118-B2 Herbicide and repellent adjuvant; reducing foliage retention; preventing damage to crops BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2011-03-08 US claimed
US-6936569-B2 Compositions and methods for protecting cultivated plants from herbicidal injury BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2005-08-30 US claimed
US-20050032645-A1 Compositions and methods for protecting cultivated plants from herbicidal injury BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2005-02-10 US claimed
EP-1258193-A1 Herbicidal compositions of tetrazolinone herbicides and antidotes therefor Syngenta Limited (GB) 2002-11-20 EP claimed
US-20020010096-A1 Compositions and methods for protecting cultivated plants from herbicidal injury BOARD OF TRUSTEES OPERATING MICHIGAN STATE UNIVERSITY 2002-01-24 US claimed
US-6235682-B1 AQUEOUS SOLUTION CONTAINING REPELLENT ADJUVANT BOARD OF TRUSTEES OPERATING MICHIGAN STATE UNIVERSITY 2001-05-22 US claimed
EP-0999748-A1 HERBICIDAL COMPOSITIONS OF TETRAZOLINONE HERBICIDES AND ANTIDOTES THEREFOR ZENECA LIMITED (GB) 2000-05-17 EP claimed
EP-0802732-B1 HERBICIDAL COMPOSITIONS OF 4-BENZOYLISOXAZOLE OR 2-CYANO-1,3-DIONE HERBICIDES AND ANTIDOTES THEREFOR ZENECA LTD (GB) 2000-04-19 EP claimed
WO-2000003595-A1 COMPOSITIONS AND METHODS FOR PROTECTING CULTIVATED PLANTS FROM HERBICIDAL INJURY MICHIGAN STATE UNIVERSITY (US) 2000-01-27 WO claimed
WO-1999003348-A1 HERBICIDAL COMPOSITIONS OF TETRAZOLINONE HERBICIDES AND ANTIDOTES THEREFOR ZENECA LIMITED (GB) 1999-01-28 WO claimed
US-5627131-A Herbicidal compositions of 4-benzoylisoxazole and antidotes therefor ZENECA LIMITED (GB) 1997-05-06 US claimed
EP-0354201-A2 Safening herbicidal benzoic acid derivatives MONSANTO COMPANY (US) 1990-02-07 EP claimed
US-7902118-B2 Herbicide and repellent adjuvant; reducing foliage retention; preventing damage to crops BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2011-03-08 US disclosed
US-6936569-B2 Compositions and methods for protecting cultivated plants from herbicidal injury BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2005-08-30 US disclosed
US-20050032645-A1 Compositions and methods for protecting cultivated plants from herbicidal injury BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2005-02-10 US disclosed
EP-1258193-A1 Herbicidal compositions of tetrazolinone herbicides and antidotes therefor Syngenta Limited (GB) 2002-11-20 EP disclosed
US-6235682-B1 AQUEOUS SOLUTION CONTAINING REPELLENT ADJUVANT BOARD OF TRUSTEES OPERATING MICHIGAN STATE UNIVERSITY 2001-05-22 US disclosed
EP-0802732-B1 HERBICIDAL COMPOSITIONS OF 4-BENZOYLISOXAZOLE OR 2-CYANO-1,3-DIONE HERBICIDES AND ANTIDOTES THEREFOR ZENECA LTD (GB) 2000-04-19 EP disclosed
WO-2000011954-A1 HERBICIDAL METHOD AVENTIS CROPSCIENCE S.A. (FR) 2000-03-09 WO disclosed
US-5627131-A Herbicidal compositions of 4-benzoylisoxazole and antidotes therefor ZENECA LIMITED (GB) 1997-05-06 US disclosed