SCHEMBL8848418

SCHEMBL8848418

CCCC1CN(C(=O)C(Cl)Cl)C(C)(C)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
SCHEMBL9506374 0.91 GRM2 (0.30)
SCHEMBL8852486 0.88
SCHEMBL11200886 0.82
SCHEMBL9509925 0.81 PDK1 (0.33)
SCHEMBL10471726 0.81
SCHEMBL9508777 0.81 PDK1 (0.30)
SCHEMBL9508721 0.78
SCHEMBL9815516 0.76
SCHEMBL8429253 0.76 SMN1; SMN2 (0.34)
SCHEMBL167473 0.76 SMN1; SMN2 (0.34)

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-5691274-A PLANT SAFTENING AGENTS FOR HERBICIDES ZENECA LIMITED (GB) 1997-11-25 US disclosed
EP-0584227-B1 HERBICIDAL SUBSTITUTED CYCLOHEXANEDIONE AND NITROGEN FERTILISER COMPOSITIONS AND METHOD ZENECA LTD (GB) 1997-10-08 EP disclosed
US-5527761-A MIXTURE OF ISOXAZOLIDINONES, DICHLOROACETAMIDES, TRIAZINE, TOLUIDINE AND SULFONYLUREA HERBICIDES ZENECA LIMITED (GB) 1996-06-18 US disclosed
US-5527762-A AMIDES OF HALOALKANOIC ACIDS, INCLUDING OXAZOLIDINES AND THIOZOLIDIENS USED AS NON-PHYTOTOXIC ANTIDOTES ZENECA LIMITED (GB) 1996-06-18 US disclosed
US-5395816-A Antidoting herbicidal 3-ixoxazolidinone compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1995-03-07 US disclosed
EP-0561970-B1 ANTIDOTING HERBICIDAL 3-ISOXAZOLIDINONE COMPOUNDS ZENECA INC (US) 1995-01-18 EP disclosed
EP-0584227-A1 HERBICIDAL SUBSTITUTED CYCLOHEXANEDIONE AND NITROGEN FERTILISER COMPOSITIONS AND METHOD. ZENECA LTD (GB) 1994-03-02 EP disclosed
EP-0561970-A1 ANTIDOTING HERBICIDAL 3-ISOXAZOLIDINONE COMPOUNDS. ZENECA INC (US) 1993-09-29 EP disclosed
EP-0298680-B1 HERBICIDAL COMPOSITIONS OF ACYLATED 1,3-DICARBONYL HERBICIDES AND ANTIDOTES THEREFOR ZENECA INC. (US) 1993-09-15 EP disclosed
US-5171356-A Thiolcarbamate and nonphytotoxic extender which minimizes soil degradation ICI AMERICAS INC. (US) 1992-12-15 US disclosed
EP-0175332-B1 HERBICIDE COMPOSITIONS OF EXTENDED SOIL LIFE STAUFFER CHEMICAL COMPANY (US) 1992-03-18 EP disclosed
US-5051125-A S-ethyl cyclohexylethyl thiocarbamate and 2-chloro-4-(ethylamino)-6-(2-cyanoisopropylamino)-s-triazine ICI AMERICAS INC. (US) 1991-09-24 US disclosed
WO-1991013547-A1 HERBICIDAL COMPOSITIONS OF AROYLATED 1,3-DICARBONYL OR 1,3,5-TRICARBONYL CYCLOHEXANE HERBICIDES AND TWO-PART ANTIDOTE SYSTEM THEREFOR AHLE JAMES L (US) 1991-09-19 WO disclosed
US-4938796-A Haloalkamides and naphthalene anhydride ICI AMERICAS INC. (US) 1990-07-03 US disclosed
EP-0298680-A2 Herbicidal compositions of acylated 1,3-dicarbonyl herbicides and antidotes therefor ZENECA INC. (US) 1989-01-11 EP disclosed
EP-0298679-A2 Herbicidal compositions of acylated 1,3,5-tricarbonyl cyclohexane herbicides and antidotes therefor ICI AMERICAS INC. (US) 1989-01-11 EP disclosed
US-4762548-A HALOALLYL-SUBSTITUTED AMIDE EXTENDER FOR A THIOLCARBAMATE STAUFFER CHEMICAL CO. (US) 1988-08-09 US disclosed
EP-0184870-A1 Synergistic herbicidal composition STAUFFER CHEMICAL COMPANY (US) 1986-06-18 EP disclosed
EP-0175332-A2 Herbicide compositions of extended soil life STAUFFER CHEMICAL COMPANY (US) 1986-03-26 EP disclosed
US-4219655-A Process for the production of N-acyl substituted oxazolidines STAUFFER CHEMICAL COMPANY (US) 1980-08-26 US disclosed