SCHEMBL4470672

SCHEMBL4470672

CCOC(=O)c1cc(C)oc1C

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.59
MAPT P10636 4/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
LMNA P02545 1/20 0.56
KDM4E B2RXH2 2/20 0.55
TSHR P16473 5/20 0.54
HPGD P15428 2/20 0.54
PPARG P37231 1/20 0.54
NCOA2 Q15596 1/20 0.54
TP53 P04637 1/20 0.52
HSD17B10 Q99714 1/20 0.52
HTT P42858 1/20 0.52
GAA P10253 1/20 0.51
MAPK1 P28482 1/20 0.51
MAPK10 P53779 1/20 0.51
NPC1 O15118 1/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL26448424 0.83 MAPT (0.49) ALDH1A1MAPTSMN1; SMN2LMNAKDM4E
SCHEMBL23462185 0.83 TSHR (0.50) ALDH1A1MAPTSMN1; SMN2LMNAKDM4E
SCHEMBL8629493 0.81 TSHR (0.48) ALDH1A1MAPTSMN1; SMN2LMNATSHR
SCHEMBL10849451 0.81 MAPK1 (0.49) ALDH1A1MAPTLMNAKDM4ETSHR
SCHEMBL10389513 0.81 NPC1 (0.53) ALDH1A1MAPTSMN1; SMN2LMNAKDM4E
SCHEMBL11264199 0.81 CYP3A4 (0.53) ALDH1A1MAPTSMN1; SMN2LMNAKDM4E
SCHEMBL19834811 0.80 TSHR (0.47) ALDH1A1MAPTSMN1; SMN2LMNAKDM4E
SCHEMBL11717329 0.80 TSHR (0.47) ALDH1A1MAPTLMNAKDM4ETSHR
SCHEMBL3179093 0.80 MAPT (0.61) ALDH1A1MAPTSMN1; SMN2LMNAKDM4E
SCHEMBL13365129 0.79 CYP4F2 (0.48) ALDH1A1MAPTLMNATSHRHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0006149-B1 PROCESS FOR THE PREPARATION OF ALKYL ESTERS OF 2,5-DIMETHYLFURAN-3-CARBOXYLIC ACID BASF Aktiengesellschaft (DE) 1982-01-06 EP claimed
US-4207243-A Preparation of 2,5-dimethylfuran-3-carboxylic acid alkyl esters BASF AKTIENGESELLSCHAFT (DE) 1980-06-10 US claimed
JP-9255675-A None JP disclosed
JP-11060569-A None JP disclosed
WO-2010059393-A1 SEROTONIN RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2010-05-27 WO disclosed
US-7608727-B2 Process for the preparation of furan compounds DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2009-10-27 US disclosed
EP-1826202-A1 Process for the preparation of furan compounds DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2007-08-29 EP disclosed
US-20070197806-A1 Process for the preparation of furan compounds DAICEL CHEMICAL INDUSTRIES, LTD. 2007-08-23 US disclosed
US-6506913-B2 Wood preservatives SANKYO COMPANY, LIMITED (JP) 2003-01-14 US disclosed
US-20020091154-A1 Dimethylfurancarboxyanilide derivatives SANKYO COMPANY LIMITED (JP) 2002-07-11 US disclosed
US-6380247-B2 A WOOD PRESERVATIVE; POTENTIATION WHEN MIXED WITH AT LEAST ONE OF 3-BROMO-2,3-DIIODO-2-PROPENYL-ETHYLCARBAMATE, 3-IODO-2-PROPYNYLBUTYL-CARBAMATE AND 4-CHLOROPHENYL-3-IODOPROPARGYLFORMAL; MICROBIOCIDES SANKYO COMPANY, LIMITED (JP) 2002-04-30 US disclosed
WO-1998042347-A1 PHARMACEUTICAL COMPOSITION CONTAINING A PHOSPHORYLAMIDE AND AN AYNTIBIOTIC TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-10-01 WO disclosed
EP-0852498-A1 PHOSPHORYLAMIDES, THEIR PREPARATION AND USE Takeda Chemical Industries, Ltd. (JP) 1998-07-15 EP disclosed
JP-H09255675-A PRODUCTION OF FURAN-3-CARBOXYAMIDE DERIVATIVE DAICEL CHEM IND LTD 1997-09-30 JP disclosed
WO-1997011705-A1 PHOSPHORYLAMIDES, THEIR PREPARATION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-04-03 WO disclosed
EP-0755927-A1 DIMETHYLFURANCARBOXANILIDE DERIVATIVE SANKYO COMPANY LIMITED (JP) 1997-01-29 EP disclosed
US-4207243-A Preparation of 2,5-dimethylfuran-3-carboxylic acid alkyl esters BASF AKTIENGESELLSCHAFT (DE) 1980-06-10 US disclosed
US-4201715-A Process for the anilidization of carboxylic acid esters WACKER-CHEMIE GMBH (DE) 1980-05-06 US disclosed
US-4025537-A Preparation of 3-carboalkoxy or 3-alkanoyl furans KRETCHMER RICHARD ALLAN 1977-05-24 US disclosed
US-3980675-A HYDROLYSIS OF A DIACETYL DIMER IN AN ACID CATALYST MONTEDISON S.P.A. (IT) 1976-09-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070197806-A1 Process for the preparation of furan compounds CBR1, CBR3, POR ALDH1A1 160/4885MAPT 4084/4885SMN1; SMN2 3095/4885
US-20020091154-A1 Dimethylfurancarboxyanilide derivatives C9, CBR1, CBR3 ALDH1A1 116/4885MAPT 3855/4885SMN1; SMN2 2164/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.