SCHEMBL108518

SCHEMBL108518

CC1CC(C)(C)CC1=O

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
SCHEMBL21247206 1.00
SCHEMBL8676575 0.75 MAPT (0.48)
SCHEMBL959131 0.75 MAPT (0.43)
SCHEMBL2691037 0.75 CYP3A4 (0.41)
SCHEMBL4599771 0.75 ALDH1A1 (0.41)
SCHEMBL3503955 0.75 ALDH1A1 (0.41)
SCHEMBL20100996 0.75 CYP3A4 (0.41)
SCHEMBL368265 0.72 MAPT (0.56)
SCHEMBL569284 0.72
SCHEMBL19784252 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3075789-B1 PROCESS FOR PRODUCING FUNCTIONALISED KETONE ALDEHYDE CONDENSATION RESINS EVONIK DEGUSSA GMBH (DE) 2018-06-27 EP claimed
EP-3075788-A1 FUNCTIONALIZED KETONE ALDEHYDE CONDENSATION RESINS Evonik Degussa GmbH (DE) 2016-10-05 EP claimed
EP-3075789-A1 FUNCTIONALISED KETONE ALDEHYDE CONDENSATION RESINS Evonik Degussa GmbH (DE) 2016-10-05 EP claimed
JP-4792027-B2 2011-10-12 JP claimed
EP-1740634-B1 POLYMER COMPOSITIONS OF CARBONYL-HYDRATED KETONE-ALDEHYDE RESINS AND POLYISOCYANATES IN REACTIVE SOLVENTS EVONIK DEGUSSA GMBH (DE) 2010-08-11 EP claimed
EP-1900773-B1 Chlorine-free composition containing silane groups EVONIK DEGUSSA GMBH (DE) 2009-07-01 EP claimed
WO-2009047102-A1 COATING MATERIAL COMPOSITIONS EVONIK DEGUSSA GMBH (DE) 2009-04-16 WO claimed
WO-2009047097-A1 PRINTING INK COMPOSITIONS EVONIK DEGUSSA GMBH (DE) 2009-04-16 WO claimed
WO-2009047047-A1 BALLPOINT PEN PASTE COMPOSITIONS EVONIK DEGUSSA GMBH (DE) 2009-04-16 WO claimed
EP-2027171-A1 FORMALDEHYDE-FREE, CARBONYL- AND RING-HYDROGENATED KETONE-ALDEHYDE RESINS BASED ON ALKYL ARYL KETONES AND FORMALDEHYDE WHICH HAVE A LOW OH FUNCTIONALITY AND A PROCESS FOR PREPARING THEM Degussa GmbH (DE) 2009-02-25 EP claimed
WO-2006018341-A1 TIN-FREE, HIGH-MELTING REACTION PRODUCTS OF CARBONYL-HYDROGENATED KETONE ALDEHYDE RESINS, HYDROGENATED KETONE RESINS, AND CARBONYL-HYDROGENATED AND CORE-HYDROGENATED KETONE ALDEHYDE RESINS BASED ON AROMATIC KETONES AND POLYISOCYANATES DEGUSSA GMBH (DE) 2006-02-23 WO claimed
WO-2005105882-A1 POLYMER COMPOSITIONS OF CARBONYL-HYDRATED KETONE-ALDEHYDE RESINS AND POLYISOCYANATES IN REACTIVE SOLVENTS DEGUSSA AG (DE) 2005-11-10 WO claimed
WO-2005075585-A1 UTILIZATION OF RADIOHARDENABLE RESINS BASED ON HYDROGENATED KETONE AND PHENOL ALDEHYDE RESINS DEGUSSA AG (DE) 2005-08-18 WO claimed
WO-2005075584-A1 UTILIZATION OF RADIOHARDENABLE RESINS BASED ON KETONE AND/OR UREA ALDEHYDE RESINS DEGUSSA AG (DE) 2005-08-18 WO claimed
US-20050043501-A1 Radiation-curable resins based on ketone-aldehyde and/or urea-aldehyde resins and a process for preparing them DEGUSSA AG (DE) 2005-02-24 US claimed
EP-1508581-A1 Radiation curable resins based on ketone and/or urea-aldehyde resins and process for their preparation Degussa AG (DE) 2005-02-23 EP claimed
EP-1508580-A1 Ketone-aldehyde resins, in particular cyclohexanone-formaldehyde resins, process for their production and their use Degussa AG (DE) 2005-02-23 EP claimed
EP-1508582-A1 Radiation curable resins based on hydrogenated ketone and/or phenol-aldehyde resins and process for their preparation Degussa AG (DE) 2005-02-23 EP claimed
EP-1486520-A1 Resin prepared with ketones and aldehydes having improved solubility characteristics and low colour index. Degussa AG (DE) 2004-12-15 EP claimed
EP-0282795-B1 2-ALKYLIDEN-3,3,5(3,5,5)-TRIMETHYLCYCLOPENTANONE AS PERFUME Henkel Kommanditgesellschaft auf Aktien (DE) 1991-04-17 EP claimed