SCHEMBL4402124

SCHEMBL4402124

CC(C)C1Cc2ccccc2C1=O

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACHE P22303 7/20 0.58
PRNP P04156 1/20 0.52
PPARG P37231 1/20 0.52
NCOR2 Q9Y618 1/20 0.52
METAP1 P53582 4/20 0.49
TSHR P16473 1/20 0.44
HTR2A P28223 3/20 0.43
HTR2C P28335 3/20 0.43
HTR2B P41595 3/20 0.43
DRD2 P14416 2/20 0.43
SIGMAR1 Q99720 1/20 0.43
CYP19A1 P11511 1/20 0.41
KDM4E B2RXH2 1/20 0.40
HTR1A P08908 1/20 0.40
HTR7 P34969 1/20 0.40
HRH1 P35367 1/20 0.40
DRD3 P35462 1/20 0.40

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
SCHEMBL4611650 1.00 ACHE (0.58) ACHEPRNPPPARGNCOR2METAP1
SCHEMBL11770519 0.85 ACHE (0.55) ACHEPRNPPPARGNCOR2METAP1
SCHEMBL10346131 0.81 KDM4E (0.55) ACHEHTR2AHTR2CHTR2BDRD2
SCHEMBL14447190 0.81 ACHE (0.50) ACHEPRNPPPARGNCOR2METAP1
SCHEMBL20207026 0.81 S100A4 (0.53) ACHEPRNPPPARGNCOR2HTR2B
SCHEMBL12237089 0.79 ACHE (0.47) ACHEPRNPPPARGNCOR2METAP1
SCHEMBL5952596 0.79 HTR1A (0.46) ACHEPRNPPPARGNCOR2HTR2A
SCHEMBL28461412 0.78 ACHE (0.50) ACHEPRNPPPARGNCOR2METAP1
SCHEMBL21294251 0.77 ACHE (0.62) ACHEPRNPPPARGNCOR2METAP1
SCHEMBL10752402 0.77 ACHE (0.49) ACHEMETAP1SIGMAR1CYP19A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190276469-A1 Cyclic Ketals As Fragrance Precursor Compounds HENKEL AG & CO. KGAA (DE) 2019-09-12 US claimed
EP-3523414-A1 CYCLIC KETALS AS FRAGRANCE PRECURSOR COMPOUNDS Henkel AG & Co. KGaA (DE) 2019-08-14 EP claimed
US-20190010293-A1 SILICONE COMPOUNDS THE PROCTER & GAMBLE COMPANY 2019-01-10 US claimed
US-20190010427-A1 SILICONE COMPOUNDS THE PROCTER & GAMBLE COMPANY 2019-01-10 US claimed
WO-2018095814-A1 CYCLIC KETALS AS FRAGRANCE PRECURSOR COMPOUNDS HENKEL AG & CO. KGAA (DE) 2018-05-31 WO claimed
US-20220009153-A1 COMPOSITION FOR FORMING PATTERN, KIT, CURED FILM, LAMINATE, PATTERN PRODUCING METHOD, AND METHOD FOR MANUFACTURING SEMICONDUCTOR ELEMENT FUJIFILM CORPORATION (JP) 2022-01-13 US disclosed
US-10941156-B2 Cyclic ketals as fragrance precursor compounds HENKEL AG & CO. KGAA (DE) 2021-03-09 US disclosed
CN-110204468-B Asymmetric synthesis method of chiral alpha-thiocyano cyclic ketonic acid ester compound 浙江工业大学 2021-02-02 CN disclosed
US-20190276469-A1 Cyclic Ketals As Fragrance Precursor Compounds HENKEL AG & CO. KGAA (DE) 2019-09-12 US disclosed
EP-3523414-A1 CYCLIC KETALS AS FRAGRANCE PRECURSOR COMPOUNDS Henkel AG & Co. KGaA (DE) 2019-08-14 EP disclosed
US-20190010293-A1 SILICONE COMPOUNDS THE PROCTER & GAMBLE COMPANY 2019-01-10 US disclosed
US-20190010427-A1 SILICONE COMPOUNDS THE PROCTER & GAMBLE COMPANY 2019-01-10 US disclosed
CN-1471570-A Fabric care compositions containing cationic polysiloxanes and methods of use thereof 2004-01-28 CN disclosed
US-6492563-B2 PROVIDES NON-VOLATILE PRECURSORS FOR VOLATILE FRAGRANT ESTERS FOR USE IN DETERGENT, A FABRIC SOFTENER, A WINDOW CLEANER, A HARD SURFACE CLEANER, AN ALL PURPOSE CLEANER, A FURNITURE POLISH, A SHAMPOO, A CONDITIONER, AN HAIRSPRAY, A COSMETIC GIVAUDAN SA (CH) 2002-12-10 US disclosed
US-20020077508-A1 Fragrance precursors GIVAUDAN SA (CH) 2002-06-20 US disclosed
US-20020035055-A1 Fragrance precursors GIVAUDAN SA (CH) 2002-03-21 US disclosed
EP-1167362-A1 Fragance precursors Givaudan SA (CH) 2002-01-02 EP disclosed
EP-1146033-A2 Fragrance precursors Givaudan SA (CH) 2001-10-17 EP disclosed
US-6258854-B1 KETONE ETHERS FOR ODORS GIVAUDAN ROURE ( INTERNATIONAL ) SA (CH) 2001-07-10 US disclosed
EP-0983990-A2 Ketones useful as precursors for organoleptic compounds Givaudan Roure (International) S.A. (CH) 2000-03-08 EP 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 (4 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-10941156-B2 Cyclic ketals as fragrance precursor compounds KCNK5, KLK5, KCNA1 ACHE 300/4885PRNP 3370/4885PPARG 4039/4885
US-20020077508-A1 Fragrance precursors ADH5, FAAH, CBR3 ACHE 3921/4885PRNP 4469/4885PPARG 2743/4885
US-20190276469-A1 Cyclic Ketals As Fragrance Precursor Compounds KCNK5, KLK5, KCNA1 ACHE 300/4885PRNP 3370/4885PPARG 4039/4885
US-20020035055-A1 Fragrance precursors FAAH2, FDPS, CYP51A1 ACHE 1455/4885PRNP 4712/4885PPARG 1670/4885

“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.