SCHEMBL1661290

SCHEMBL1661290

CCOC(=O)C(c1ccccc1)C(C)C

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.54
KMT2A Q03164 2/20 0.53
PIN1 Q13526 1/20 0.50
CHRM2 P08172 2/20 0.49
CHRM4 P08173 2/20 0.49
CHRM1 P11229 2/20 0.49
CHRM3 P20309 2/20 0.49
MEN1 O00255 1/20 0.49
NPC1 O15118 1/20 0.49
CYP2D6 P10635 2/20 0.48
CHRM5 P08912 1/20 0.48
SIGMAR1 Q99720 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TSHR P16473 2/20 0.46
GAA P10253 1/20 0.45
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL5728738 0.90 KMT2A (0.64) MMP8KMT2APIN1CHRM2CHRM4
SCHEMBL1645937 0.89 MMP8 (0.51) MMP8KMT2APIN1CHRM2CHRM4
SCHEMBL1646940 0.89 MMP8 (0.51) MMP8KMT2APIN1CHRM2CHRM4
SCHEMBL28497599 0.89 MMP8 (0.54) MMP8KMT2APIN1CHRM2CHRM4
SCHEMBL25600199 0.87 MMP8 (0.53) MMP8KMT2APIN1CHRM2CHRM4
SCHEMBL28258997 0.87 MMP8 (0.53) MMP8KMT2APIN1CHRM2CHRM4
SCHEMBL27629137 0.86 MMP8 (0.51) MMP8KMT2APIN1CHRM2CHRM4
SCHEMBL25602723 0.86 MMP8 (0.51) MMP8KMT2APIN1CHRM2CHRM4
SCHEMBL27672937 0.86 CHRM1 (0.54) KMT2ACHRM2CHRM4CHRM1CHRM3
SCHEMBL11160334 0.85 SLC22A1 (0.44) MMP8KMT2APIN1CHRM2CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4391827-A1 METHOD OF MITIGATING OFF-ODORS Givaudan SA (CH) 2024-07-03 EP claimed
US-20240197221-A1 FRAGRANCE FOR IMPROVING HAPPINESS STATE AND METHOD OF ASSESSING GIVAUDAN SA (CH) 2024-06-20 US claimed
EP-4347758-A1 FRAGRANCE FOR IMPROVING HAPPINESS STATE AND METHOD OF ASSESSING Givaudan SA (CH) 2024-04-10 EP claimed
US-20240000746-A1 New Cooling Agents and Preparations Containing Them SYMRISE AG (DE) 2024-01-04 US claimed
WO-2023168069-A1 FRAGRANCE COMPOSITIONS FOR SLEEP IMPROVEMENT INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2023-09-07 WO claimed
WO-2023025549-A1 METHOD OF MITIGATING OFF-ODORS GIVAUDAN SA (CH) 2023-03-02 WO claimed
US-20200048578-A1 ORGANIC COMPOUNDS GIVAUDAN S.A. (CH) 2020-02-13 US claimed
US-20180051231-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2018-02-22 US claimed
EP-3271443-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS Givaudan SA (CH) 2018-01-24 EP claimed
WO-2016146673-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2016-09-22 WO claimed
US-4332829-A Methylthiomethyl esters as flavor additives POLAK'S FRUTAL WORKS, B.V. (NL) 1982-06-01 US claimed
EP-4214211-B1 SECO-AMBRAKETALS SYMRISE AG (DE) 2024-07-10 EP disclosed
EP-4391827-A1 METHOD OF MITIGATING OFF-ODORS Givaudan SA (CH) 2024-07-03 EP disclosed
US-20240206778-A1 FRAGRANCE FOR IMPROVING INVIGORATION STATE AND METHOD OF ASSESSING GIVAUDAN SA (CH) 2024-06-27 US disclosed
US-20240197221-A1 FRAGRANCE FOR IMPROVING HAPPINESS STATE AND METHOD OF ASSESSING GIVAUDAN SA (CH) 2024-06-20 US disclosed
US-4071535-A 2-Alkyl-4-phenyl-dihydropyrans and processes for augmenting the organoleptic properties of foodstuffs and tobacco using one or more of said pyrans INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1978-01-31 US disclosed
US-4070491-A 2-Alkyl-4-phenyl-dihydropyrans and processes for augmenting the organoleptic properties of foodstuffs and tobacco using one or more of said pyrans INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1978-01-24 US disclosed
US-4067344-A Novel tobacco product comprising one or more thiazolines and process INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1978-01-10 US disclosed
US-3977419-A TOBACCO ARTICLE COMPRISING A FLAVORING COMPOSITION SELECTED FROM BUTANONE DERIVATIVES AND THE PROCESS FOR MAKING THE SAME INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1976-08-31 US disclosed
US-3977418-A TOBACCO ARTICLE COMPRISING THE FLAVORING COMPOSITION TRICYCLENE-9-BUTENONE AND THE PROCESS FOR MAKING THE SAME INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1976-08-31 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 (1 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-20240000746-A1 New Cooling Agents and Preparations Containing Them TTPA, TREH, TAS2R45 MMP8 2018/4885KMT2A 4030/4885PIN1 4442/4885

“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.