SCHEMBL6559004

SCHEMBL6559004

C[C]1CC2C=CC1C2

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
SCHEMBL6561371 0.77
SCHEMBL31490441 0.69
SCHEMBL384535 0.69
SCHEMBL18277428 0.69
SCHEMBL22997 0.69 HSD17B10 (0.47)
SCHEMBL7535878 0.69 HSD17B10 (0.47)
SCHEMBL4367018 0.69 HSD17B10 (0.47)
SCHEMBL697445 0.68
Iodide SCHEMBL11882843 0.67 HSD17B10 (0.96)
SCHEMBL28374429 0.67 HSD17B10 (0.96)

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 28 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
EP-1477485-A1 Aminophenol derivatives Bayer CropScience AG (DE) 2004-11-17 EP disclosed
EP-0934302-B1 AMINOPHENOL DERIVATES BAYER CROPSCIENCE AG (DE) 2004-08-25 EP disclosed
US-6476240-B2 POLYMERS DERIVED FROM AN UNSATURATED FUSED CYCLIC HYDROCARBON (SUCH AS PERHYDRO-2,3-DIDEHYDRO-1,4:5,8-DIMETHANONAPHTHALENE) JOINED BY A LINKER TO AN ESTER GROUP HAVING ONE OR TWO PROTECTED HYDROXYLS; USE AS PHOTORESIST WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2002-11-05 US disclosed
US-20020042531-A1 Polymers derived from an unsaturated fused cyclic hydrocarbon (such as perhydro-2,3-didehydro-1,4:5,8-dimethanonaphthalene) joined by a linker to an ester group having one or two protected hydroxyls; use as photoresist WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2002-04-11 US disclosed
US-6331602-B1 Monomer and a polymer obtained therefrom WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2001-12-18 US disclosed
EP-0808102-B1 FUNGICIDE BASF AG (DE) 2001-08-22 EP disclosed
EP-0888288-B1 FUNGICIDALLY ACTIVE CARBOXYLIC ACID AMIDES BASF AG (DE) 2001-06-13 EP disclosed
EP-0888288-A1 FUNGICIDALLY ACTIVE CARBOXYLIC ACID AMIDES BASF AKTIENGESELLSCHAFT (DE) 1999-01-07 EP disclosed
WO-1998016522-A2 AMINOPHENOL DERIVATES WITH FUNGICIDAL PROPERTY BAYER AKTIENGESELLSCHAFT (DE) 1998-04-23 WO disclosed
EP-0808102-A1 FUNGICIDE BASF AKTIENGESELLSCHAFT (DE) 1997-11-26 EP disclosed
WO-1997035838-A1 FUNGICIDALLY ACTIVE CARBOXYLIC ACID AMIDES BASF AKTIENGESELLSCHAFT (DE) 1997-10-02 WO disclosed
EP-0653418-B1 P-hydroxy-aniline derivatives, process for their preparation and their use as fungicides or pesticides BASF AG (DE) 1997-03-05 EP disclosed
WO-1996024249-A1 FUNGICIDE BASF AKTIENGESELLSCHAFT (DE) 1996-08-15 WO disclosed
US-5534653-A FUNGICIDES, PESTICIDES BASF AKTIENGESELLSCHAFT (DE) 1996-07-09 US disclosed
EP-0653418-A1 P-hydroxy-aniline derivatives, process for their preparation and their use as fungicides or pesticides BASF Aktiengesellschaft (DE) 1995-05-17 EP disclosed