SCHEMBL2466697

SCHEMBL2466697

CCC(C)(C)[K]

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
SCHEMBL2153288 0.67 TSHR (1.00)
SCHEMBL1936538 0.67
SCHEMBL22537 0.67
SCHEMBL585572 0.65
SCHEMBL156986 0.64 TSHR (0.43)
SCHEMBL7873106 0.64
SCHEMBL277066 0.64 TSHR (0.43)
SCHEMBL18131684 0.64
SCHEMBL134136 0.63
SCHEMBL597698 0.63 TSHR (0.55)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5292790-A Modified butadiene-styrene copolymer and carbon black; high strength, abrasion resistance, low fuel consumption after vulcanization BRIDGESTONE CORPORATION (JP) 1994-03-08 US claimed
US-5021380-A Contacting nickel/II/ compound with organophosphine and bidentate nitrogen-containing ligands and tertiary-alkyl organometallic compound in nonpolar ether solvent to form nickel/0/ species EASTMAN KODAK COMPANY (US) 1991-06-04 US claimed
US-4939309-A REACTING ARYL HALIDE WITH NICKEL-ORGANOPHOSPHINE-ORGANOMETAL-LIC-BIDENTATE LIGAND CATALYST EASTMAN KODAK COMPANY (US) 1990-07-03 US claimed
EP-1980575-B1 A METHOD OF GEL INHIBITION FOR THE HOMOPOLYMERIZATION OR COPOLYMERIZATION PROCESS OF CONJUGATED DIENE CHINA PETROLEUM & CHEMICAL (CN) 2011-09-07 EP disclosed
EP-1980575-A1 A METHOD OF GEL INHIBITION FOR THE HOMOPOLYMERIZATION OR COPOLYMERIZATION PROCESS OF CONJUGATED DIENE China Petroleum &amp; Chemical Corporation (CN) 2008-10-15 EP disclosed
US-6784305-B2 DERIVATIVES OF ZIRCONOCENE DICHLORIDE IN WHICH THE TWO SUBSTITUTED INDENYL GROUPS ARE JOINED TO ONE ANOTHER VIA A BRIDGE CAN, OWING TO THEIR CONFORMATIONAL RIGIDITY, BE USED AS CATALYSTS FOR THE STEREOSPECIFIC POLYMERIZATION OF OLEFINS BASELL POLYOLEFINE GMBH (DE) 2004-08-31 US disclosed
US-20030236439-A1 Non-steroidal analogs of 2-methoxyestradiol ENTREMED, INC. 2003-12-25 US disclosed
US-20030199703-A1 Method for producing alkyl-bridged ligand systems and transition metal compounds EQUISTAR CHEMICALS, LP 2003-10-23 US disclosed
US-20030187076-A1 Non-steroidal analogs of 2-methoxyestradiol ENTREMED, INC. 2003-10-02 US disclosed
WO-2003063791-A2 NON-STEROIDAL ANALOGS OF 2-METHOXYESTRADIOL ENTREMED, INC. (US) 2003-08-07 WO disclosed
WO-2003063787-A2 NON-STEROIDAL ANALOGS OF 2-METHOXYESTRADIOL ENTREMED, INC. (US) 2003-08-07 WO disclosed
EP-0593049-A1 Anionic polymerization initiators and reduced hysteresis products therefrom BRIDGESTONE CORPORATION (JP) 1994-04-20 EP disclosed
US-5292790-A Modified butadiene-styrene copolymer and carbon black; high strength, abrasion resistance, low fuel consumption after vulcanization BRIDGESTONE CORPORATION (JP) 1994-03-08 US disclosed
US-5021380-A Contacting nickel/II/ compound with organophosphine and bidentate nitrogen-containing ligands and tertiary-alkyl organometallic compound in nonpolar ether solvent to form nickel/0/ species EASTMAN KODAK COMPANY (US) 1991-06-04 US disclosed
US-4939309-A REACTING ARYL HALIDE WITH NICKEL-ORGANOPHOSPHINE-ORGANOMETAL-LIC-BIDENTATE LIGAND CATALYST EASTMAN KODAK COMPANY (US) 1990-07-03 US disclosed
US-4525560-A PRODUCING HIGH LEVELS OF POLYMER SOLIDS WITHOUT REQUIRING COOLING,INCREMENTAL ADDITIONS, RECYCLING A PORTION OF TERMINATED POLYMER SMITH RICHARD L 1985-06-25 US disclosed
US-4311803-A Continuous solution polymerization process PHILLIPS PETROLEUM COMPANY (US) 1982-01-19 US disclosed
EP-0019100-A1 Continuous solution polymerization process PHILLIPS PETROLEUM COMPANY (US) 1980-11-26 EP disclosed
US-4137391-A Continuous solution polymerization of a conjugated diene with a monovinylaromatic compound using alkoxysilicon treating agents in the first reactor means of a reactor series PHILLIPS PETROLEUM COMPANY (US) 1979-01-30 US disclosed
US-4091198-A Suppressing gel in the continuous solution polymerization of a conjugated diene with a monovinyl aromatic compound PHILLIPS PETROLEUM COMPANY (US) 1978-05-23 US disclosed