SCHEMBL449072

SCHEMBL449072

[CH2]CC(C)(C)[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
SCHEMBL126731 0.73
SCHEMBL987505 0.69
SCHEMBL127725 0.67
SCHEMBL100145 0.67
SCHEMBL8961142 0.65
SCHEMBL1963889 0.65
SCHEMBL97628 0.65
SCHEMBL39647 0.65
SCHEMBL9487996 0.64
SCHEMBL127112 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4134386-B1 ADDUCT COMPOSITIONS MADE OF DIISOCYANATES AND HYDROXY- OR AMINO-FUNCTIONALIZED ALKYLSULFONIC ACIDS AND/OR ALKYLSULFONIC ACID DERIVATIVES EVONIK OPERATIONS GMBH (DE) 2023-11-08 EP claimed
EP-2032523-B1 PROCESS FOR PREPARATION OF ALKOXYLATED ALKYLAMINES / ALKYL ETHER AMINES WITH PEAKED DISTRIBUTION AKZO NOBEL NV (NL) 2012-06-20 EP claimed
EP-1288235-B1 Agents for the improvement of the vulcanisation behaviour in the preparation of grafted or crosslinked polymers and filled resins EVONIK DEGUSSA GMBH (DE) 2008-02-20 EP claimed
US-5427715-A Electrically conductive plastics compositions and the use thereof CIBA-GEIGY CORPORATION (US) 1995-06-27 US claimed
EP-0566536-A1 Electrically conducting polymer compositions and their use Japat Ltd (CH) 1993-10-20 EP claimed
EP-0354429-A1 Substituted dioxolanes, method for their preparation and their use as pesticides BAYER AG (DE) 1990-02-14 EP claimed
EP-0337229-A2 Substituted pyri(mi)dines BAYER AG (DE) 1989-10-18 EP claimed
EP-0302365-A2 Substituted pyridines BAYER AG (DE) 1989-02-08 EP claimed
EP-0142040-A2 Substituted pyrimidines BAYER AG (DE) 1985-05-22 EP claimed
US-20120065302-A1 METHOD FOR USING SILANES AND SILANE BLENDS IN WOOD-PLASTIC COMPOSITE MANUFACTURING EVONIK DEGUSSA GMBH (DE) 2012-03-15 US disclosed
EP-1893695-A2 STYRYL SULFIDE DYES Ciba Specialty Chemicals Holding Inc. (CH) 2008-03-05 EP disclosed
EP-1893694-A2 SULFIDE DYES CIBA SPECIALTY CHEMICALS HOLDING INC. Patent Departement (CH) 2008-03-05 EP disclosed
EP-1893697-A2 NITROSULFIDE DYES CIBA SPECIALTY CHEMICALS HOLDING INC. Patent Departement (CH) 2008-03-05 EP disclosed
WO-2006136518-A2 NITROSULFIDE DYES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2006-12-28 WO disclosed
EP-0354429-A1 Substituted dioxolanes, method for their preparation and their use as pesticides BAYER AG (DE) 1990-02-14 EP disclosed
EP-0337229-A2 Substituted pyri(mi)dines BAYER AG (DE) 1989-10-18 EP disclosed
EP-0302365-A2 Substituted pyridines BAYER AG (DE) 1989-02-08 EP disclosed
EP-0142040-A2 Substituted pyrimidines BAYER AG (DE) 1985-05-22 EP disclosed
US-4219675-A Batch process for manufacturing and purifying liquid organic peroxide by distillation PENNWALT CORPORATION (US) 1980-08-26 US disclosed
US-4075236-A FROM ACID CHLORIDE, A HYDROPEROXIDE AND AN ALKALI METAL HYDROXIDE PENNWALT CORPORATION (US) 1978-02-21 US disclosed