SCHEMBL6572567

SCHEMBL6572567

CC(C)c1cccc(CCCC=O)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 2/20 0.39
HDAC8 Q9BY41 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HTT P42858 2/20 0.39
TYR P14679 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MDM4 O15151 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
ALOX12 P18054 1/20 0.39
CA5A P35218 1/20 0.39
MDM2 Q00987 1/20 0.39
CA9 Q16790 1/20 0.39
HDAC2 Q92769 1/20 0.39

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
SCHEMBL11198497 0.94 CYSLTR2 (0.42) HDAC4HDAC8SMN1; SMN2HTTTYR
SCHEMBL4227993 0.90 TYR (0.41) HDAC4HDAC8SMN1; SMN2HTTTYR
SCHEMBL31634534 0.90 TYR (0.41) HDAC4HDAC8SMN1; SMN2HTTTYR
SCHEMBL16775434 0.87 DAO (0.48) CYSLTR2CYSLTR1PTGIRDAOLMNA
SCHEMBL453825 0.80 TYR (0.44) HDAC4HDAC8SMN1; SMN2HTTTYR
SCHEMBL3249124 0.79 TYR (0.45) SMN1; SMN2HTTTYRKDM4EALDH1A1
SCHEMBL27535907 0.79 LPL (0.46) HDAC4HDAC8SMN1; SMN2HTTTYR
SCHEMBL8464288 0.79 CYSLTR2 (0.48) SMN1; SMN2BCHECYSLTR2CYSLTR1NPC1
SCHEMBL9027057 0.78 CYSLTR2 (0.44) HDAC4HDAC8SMN1; SMN2HTTTYR
SCHEMBL22320003 0.77 TSHR (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4021900-B1 2,2,6-TRIMETHYL-4,5-DIHYDRO-3H-OXEPINE AS AROMA INGREDIENT BASF SE (DE) 2023-10-11 EP claimed
EP-4096618-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS Symrise AG (DE) 2022-12-07 EP claimed
US-20220281834-A1 2,2,6-TRIMETHYL-4,5-DIHYDRO-3H-OXEPINE AS AROMA INGREDIENT BASF SE (DE) 2022-09-08 US claimed
EP-4021900-A1 2,2,6-TRIMETHYL-4,5-DIHYDRO-3H-OXEPINE AS AROMA INGREDIENT BASF SE (DE) 2022-07-06 EP claimed
WO-2022122143-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS SYMRISE AG (DE) 2022-06-16 WO claimed
WO-2021037806-A1 2,2,6-TRIMETHYL-4,5-DIHYDRO-3H-OXEPINE AS AROMA INGREDIENT BASF SE (DE) 2021-03-04 WO claimed
EP-4731617-A1 USE OF DIHYDROPYRAN DERIVATIVES AS AROMA CHEMICALS BASF SE (DE) 2026-04-29 EP disclosed
EP-4728447-A1 ENVIRONMENTAL ATTRIBUTES FOR AROMA CHEMICAL BASF SE (DE) 2026-04-22 EP disclosed
EP-4716732-A1 USE OF ALKYL 4-ALKOXYPENTANOATES AS AROMA CHEMICALS BASF SE (DE) 2026-04-01 EP disclosed
WO-2025228901-A2 BIOCATALYTIC PROCESS FOR THE PRODUCTION OF AROMA CHEMICALS BASF SE (DE) 2025-11-06 WO disclosed
US-20250136539-A1 ESTERS OF 5-METHYLHEX-2-ENOL AND THEIR USE AS AROMA CHEMICALS BASF SE (DE) 2025-05-01 US disclosed
US-20250011274-A1 USE OF 1-(4- TERT- BUTYL CYCLOHEXYL) PROPYL ACETATE AS AROMA INGREDIENT BASF SE (DE) 2025-01-09 US disclosed
WO-2024260772-A1 USE OF DIHYDROPYRAN DERIVATIVES AS AROMA CHEMICALS BASF SE (DE) 2024-12-26 WO disclosed
WO-2022175314-A1 IMPROVEMENT IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2022-08-25 WO disclosed
WO-2021122674-A1 2,4-DIETHYLOCTA-2,6-DIENAL AND ITS USE AS AROMA CHEMICAL BASF SE (DE) 2021-06-24 WO disclosed
EP-3838882-A1 2,4-DIETHYLOCTA-2,6-DIENAL AND ITS USE AS AROMA CHEMICAL BASF SE (DE) 2021-06-23 EP disclosed
EP-2799864-A1 Method to evaluate fragrance compositions The Procter and Gamble Company (US) 2014-11-05 EP disclosed
EP-2799863-A1 Method to evaluate fragrance compositions The Procter and Gamble Company (US) 2014-11-05 EP disclosed
EP-1385470-A1 FRAGRANT MIXTURES WITH INCREASED STRENGTH OF ODOR Symrise GmbH & Co. KG (DE) 2004-02-04 EP disclosed
WO-2002076421-A1 FRAGRANT MIXTURES WITH INCREASED STRENGTH OF ODOR SYMRISE GMBH & CO. KG (DE) 2002-10-03 WO 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 (3 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-20250136539-A1 ESTERS OF 5-METHYLHEX-2-ENOL AND THEIR USE AS AROMA CHEMICALS ENY2, SCD5, NOTUM HDAC4 4769/4885HDAC8 4355/4885SMN1; SMN2 1942/4885
US-20220281834-A1 2,2,6-TRIMETHYL-4,5-DIHYDRO-3H-OXEPINE AS AROMA INGREDIENT DRD4, HTR5A, HTR4 HDAC4 1124/4885HDAC8 3302/4885SMN1; SMN2 2116/4885
US-20250011274-A1 USE OF 1-(4- TERT- BUTYL CYCLOHEXYL) PROPYL ACETATE AS AROMA INGREDIENT NONO, NOTUM, POU5F1 HDAC4 1518/4885HDAC8 2205/4885SMN1; SMN2 3505/4885

“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.