SCHEMBL6561371

SCHEMBL6561371

C[C]1CC2C=CC1CC2

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
SCHEMBL6559004 0.77
SCHEMBL6558982 0.75
SCHEMBL8071530 0.70 HSD17B10 (0.32)
SCHEMBL7297953 0.63 GSK3A (0.38)
SCHEMBL7033066 0.63
SCHEMBL3276103 0.60
SCHEMBL137542 0.60
Ethane SCHEMBL5851586 0.56
SCHEMBL11950255 0.54 HKDC1 (0.35)
SCHEMBL11183068 0.54

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1477485-A1 Aminophenol derivatives Bayer CropScience AG (DE) 2004-11-17 EP claimed
EP-0934302-B1 AMINOPHENOL DERIVATES BAYER CROPSCIENCE AG (DE) 2004-08-25 EP claimed
US-6194443-B1 Aminophenol derivatives with fungicidal property BAYER AKTIENGESELLSCHAFT (DE) 2001-02-27 US claimed
EP-0934302-A2 AMINOPHENOL DERIVATES BAYER AG (DE) 1999-08-11 EP claimed
WO-1998016522-A2 AMINOPHENOL DERIVATES WITH FUNGICIDAL PROPERTY BAYER AKTIENGESELLSCHAFT (DE) 1998-04-23 WO claimed
US-5288410-A Adding polyacrylic acid, copolymer of allyl sulfonate and maleic anhydride, copolymer of acrylic acid and acrylamide, and additives W. R. GRACE & CO.-CONN. (US) 1994-02-22 US claimed
US-5200105-A A combination of additives: polyacrylic acid, copolymer of acrylic acid and acrylamide, and amino(trimethylene)phosphonic acid W. R. GRACE & CO.-CONN. (US) 1993-04-06 US claimed
US-20210307332-A1 POLYMER-STABILIZED AQUEOUS HYDROGEN PEROXIDE SOLUTIONS AND ASSOCIATED METHODS EVONIK CORPORATION (US) 2021-10-07 US disclosed
EP-3830027-A1 POLYMER-STABILIZED AQUEOUS HYDROGEN PEROXIDE SOLUTIONS AND ASSOCIATED METHODS Evonik Corporation (US) 2021-06-09 EP disclosed
EP-2759621-B1 Reactive-type chemical conversion treatment composition and production method of member with chemical conversion coated surface YUKEN IND CO LTD (JP) 2021-06-02 EP disclosed
WO-2020028655-A1 POLYMER-STABILIZED AQUEOUS HYDROGEN PEROXIDE SOLUTIONS AND ASSOCIATED METHODS EVONIK CORPORATION (US) 2020-02-06 WO disclosed
US-9915006-B2 Reactive-type chemical conversion treatment composition and production method of member with chemical conversion coated surface YUKEN INDUSTRY CO., LTD. (JP) 2018-03-13 US disclosed
US-20170009363-A1 REACTIVE-TYPE CHEMICAL CONVERSION TREATMENT COMPOSITION AND PRODUCTION METHOD OF MEMBER WITH CHEMICAL CONVERSION COATED SURFACE YUKEN INDUSTRY CO., LTD. (JP) 2017-01-12 US disclosed
US-4148742-A DISCOLORATION INHIBITION MONSANTO COMPANY (US) 1979-04-10 US disclosed
US-4146495-A Detergent compositions comprising polyacetal carboxylates MONSANTO COMPANY (US) 1979-03-27 US disclosed
US-4144226-A BIODEGRADABLE DETERGENT BUILDERS MONSANTO COMPANY (US) 1979-03-13 US disclosed
EP-0001004-A1 Polymeric acetal carboxylates, a method for their preparation and their use in a detergent composition MONSANTO COMPANY (US) 1979-03-07 EP disclosed
US-4108801-A A BLEND OF LINEAR ALKYL BENZENESULFONATES AND A SALT OF A TRICARBOXYLIC ACID MONSANTO COMPANY (US) 1978-08-22 US disclosed
US-4092348-A Octasodium-1,1,2,2,4,4,5,5-cyclohexane octacarboxylate and compositions and methods employing same MONSANTO COMPANY (US) 1978-05-30 US disclosed
US-3993574-A Builder compositions MONSANTO COMPANY (US) 1976-11-23 US disclosed