SCHEMBL5679003

SCHEMBL5679003

CC1C=CC(C(C)C)C=C1

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
SCHEMBL8909627 0.86
SCHEMBL790973 0.73
SCHEMBL19750571 0.65
SCHEMBL20289158 0.65
SCHEMBL25223798 0.64
SCHEMBL25129771 0.63 MEN1 (0.30)
SCHEMBL25129790 0.61
SCHEMBL6525972 0.57
SCHEMBL22754234 0.57
SCHEMBL18104306 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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0947572-B1 Heat transfer fluid compositions for low temperature applications LOIKITS IND SERVICES (US) 2003-11-26 EP claimed
WO-1997008116-A1 FLUID HEAT TRANSFER MEDIUM AND HEAT TRANSFER PROCESS LOIKITS INDUSTRIAL SERVICES (US) 1997-03-06 WO claimed
EP-1208972-B1 Method of lithographic printing with a reusable substrate. AGFA GEVAERT (BE) 2006-02-08 EP disclosed
US-6893798-B2 Heating a microemulsion of a cyclic organic compound with a double bond, an alcohol, water and an emulsifying agent to obtain aqueous and organic phases, which are separated AGFA-GEVAERT (BE) 2005-05-17 US disclosed
EP-1118471-B1 Method of lithographic printing with a reusable substrate AGFA GEVAERT (BE) 2004-12-22 EP disclosed
US-6802258-B2 CLEANING SUBSTRATE WITH AQUEOUS EMULSION OF ALCOHOL AND CYCLIC COMPOUND HAVING DOUBLE BOND, TREATING WITH AQUEOUS SOLUTION HAVING PH&lt;7; INK-ACCEPTING AREAS OF PRINTING MASTER CAN BE REMOVED MORE EFFECTIVELY FOR REUSE OF SUBSTRATE IN NEXT CYCLE AGFA-GEVAERT (BE) 2004-10-12 US disclosed
EP-1188578-B1 Method of lithographic printing with a reusable substrate AGFA GEVAERT (BE) 2004-03-31 EP disclosed
US-6701843-B2 GENTLE CLEANING USING A WATER EMULSION OF AN ALCOHOL AND CYCLIC HYDROCARBON HAVING AT LEAST ONE DOUBLE BOND WITH PHOSPHORIC ACID, A PHOSPHATE SALT, OR A POLYVINYLPHOSPHONIC ACID AGFA-GEVAERT (BE) 2004-03-09 US disclosed
EP-1188579-B1 Method of lithographic printing with a reusable substrate AGFA GEVAERT (BE) 2004-01-28 EP disclosed
EP-1118474-B1 METHOD FOR RECYCLING LITHOGRAPHIC PRINTING PLATES. AGFA GEVAERT (BE) 2003-12-03 EP disclosed
US-6484638-B2 Method of offset printing with a reusable substrate AGFA-GEVAERT (BE) 2002-11-26 US disclosed
US-20020108518-A1 Method of lithographic printing with a reusable substrate AGFA-GEVAERT (BE) 2002-08-15 US disclosed
US-20020106585-A1 Heating a microemulsion of a cyclic organic compound with a double bond, an alcohol, water and an emulsifying agent to obtain aqueous and organic phases, which are separated AGFA-GEVAERT (BE) 2002-08-08 US disclosed
EP-1208972-A1 Method of lithographic printing with a reusable substrate. Agfa-Gevaert (BE) 2002-05-29 EP disclosed
US-20020053296-A1 Method of lithographic printing with a reusable substrate AGFA-GEVAERT (BE) 2002-05-09 US disclosed
EP-1188579-A1 Method of lithographic printing with a reusable substrate Agfa-Gevaert (BE) 2002-03-20 EP disclosed
EP-1188578-A1 Method of lithographic printing with a reusable substrate Agfa-Gevaert (BE) 2002-03-20 EP disclosed
EP-1118474-A1 Method for making micro-emulsions Agfa-Gevaert (BE) 2001-07-25 EP disclosed
EP-1118471-A1 Method of lithographic printing with a reusable substrate Agfa-Gevaert naamloze vennootschap (BE) 2001-07-25 EP disclosed
US-20010008104-A1 Method of offset printing with a reusable substrate AGFA GRAPHICS NV (BE) 2001-07-19 US disclosed