SCHEMBL3030245

SCHEMBL3030245

CC[CH]CC(C)(C)C

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
SCHEMBL4294983 0.81 TSHR (0.36)
SCHEMBL28202413 0.76
SCHEMBL7054572 0.73
SCHEMBL4618318 0.73
SCHEMBL28069945 0.73
SCHEMBL23069462 0.73
SCHEMBL5949716 0.73
SCHEMBL8413508 0.73
SCHEMBL3654899 0.73
SCHEMBL620975 0.71 TSHR (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220033730-A1 ANTIOXIDANT MIXTURE FOR LOW VISCOUS POLYALKYLENE GLYCOL BASESTOCK BASF SE (DE) 2022-02-03 US claimed
CN-113166671-A Antioxidant mixtures for low viscosity polyalkylene glycol base stocks 巴斯夫欧洲公司 2021-07-23 CN claimed
CN-113166672-A Antioxidant mixtures for high viscosity polyalkylene glycol base stocks 巴斯夫欧洲公司 2021-07-23 CN claimed
US-6750184-B2 WITH DIPHENYLAMINES AND ZINC DITHIOPHOSPHATES; SUPERIOR ANTIOXIDATIVE PROPERTIES; RESISTS SLUDGE FORMATION CIBA SPECIALTY CHEMICALS CORPORATION 2004-06-15 US claimed
US-6407231-B1 CYCLIZATION OF DIPHENYLAMINE COMPOUND; ONE POT PROCESS CIBA SPECIALTY CHEMICALS CORPORATION 2002-06-18 US claimed
US-20020065201-A1 Lubricants with 5-tert.-butyl-4-hydroxy-3-methylphenyl substituted fatty acid esters CIBA SPECIALTY CHEMICALS CORP. 2002-05-30 US claimed
EP-1067124-A1 Process for the preparation of a mixture of alkylated phenothiazines and diphenylamines Ciba SC Holding AG (CH) 2001-01-10 EP claimed
EP-0560267-B1 Isosteric antiherpes peptide derivatives BOEHRINGER INGELHEIM CA LTD (CA) 1998-08-19 EP claimed
EP-0767671-A1 METHOD OF COMBATING ACYCLOVIR-RESISTANT HERPES SIMPLEX VIRAL INFECTIONS BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 1997-04-16 EP claimed
US-5574015-A Isosteric antiherpes peptide derivatives BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1996-11-12 US claimed
JP-H08507760-A 1996-08-20 JP claimed
US-5476841-A Inhibitors of herpes viral ribonucleotide reductase BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1995-12-19 US claimed
WO-1994025046-A1 METHOD OF COMBATING ACYCLOVIR-RESISTANT HERPES SIMPLEX VIRAL INFECTIONS BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1994-11-10 WO claimed
EP-0618226-A1 Inhibitors of herpes viral ribonculeotide reductase BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1994-10-05 EP claimed
WO-1994020528-A1 INHIBITORS OF HERPES VIRAL RIBONUCLEOTIDE REDUCTASE BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1994-09-15 WO claimed
WO-1993018056-A1 ISOSTERIC ANTIHERPES PEPTIDE DERIVATIVES BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1993-09-16 WO claimed
EP-0560267-A1 Isosteric antiherpes peptide derivatives BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1993-09-15 EP claimed
US-20240174947-A1 SURFACTANT COMPOSITIONS LANKEM LTD. (GB) 2024-05-30 US disclosed
US-4435315-A COSMETICS, DETERGENTS HENKEL KOMMANDITGESELLSCHAFT AUF ATKIEN (DE) 1984-03-06 US disclosed
EP-0033928-A2 Use of alkyl-substituted 1,3-dioxolanes as perfumes, and perfume compositions containing them Henkel Kommanditgesellschaft auf Aktien (DE) 1981-08-19 EP disclosed