SCHEMBL5159306

SCHEMBL5159306

CCCC(S)CCOCC

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
TSHR P16473 1/20 0.30

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
SCHEMBL10788092 0.90 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL11757771 0.82
SCHEMBL385017 0.78
SCHEMBL29473930 0.77
SCHEMBL5163671 0.77
SCHEMBL27859462 0.75 ALDH1A1 (0.36) ALDH1A1TSHR
Water SCHEMBL7548465 0.74
SCHEMBL27494246 0.74 TSHR (0.33) TSHR
SCHEMBL11765200 0.74
SCHEMBL11989343 0.74 ALDH1A1 (0.39) ALDH1A1TSHR

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1249446-B1 Use of thio derivates as flavoring ingredients FIRMENICH & CIE (CH) 2007-03-07 EP claimed
US-20030040460-A1 Use of thio derivatives as perfuming and flavoring ingredients FIRMENICH SA (CH) 2003-02-27 US claimed
EP-1249446-A2 Use of thio derivates as perfuming and flavoring ingredients FIRMENICH SA (CH) 2002-10-16 EP claimed
EP-4416125-A1 ENOL ETHER PROPERFUME Firmenich SA (CH) 2024-08-21 EP disclosed
EP-4225261-A1 ANTIPERSPIRANT COMPOSITION Coty Inc. (US) 2023-08-16 EP disclosed
WO-2023111006-A1 ENOL ETHER PROPERFUME FIRMENICH SA (CH) 2023-06-22 WO disclosed
WO-2022076469-A1 ANTIPERSPIRANT COMPOSITION COTY INC. (US) 2022-04-14 WO disclosed
EP-3897957-A1 PROCESS FOR PREPARING POLYAMIDE MICROCAPSULES Firmenich SA (CH) 2021-10-27 EP disclosed
EP-3897956-A1 POLYAMIDE MICROCAPSULES Firmenich SA (CH) 2021-10-27 EP disclosed
EP-3894064-A1 PROCESS FOR PREPARING MICROCAPSULES Firmenich SA (CH) 2021-10-20 EP disclosed
WO-2020234262-A1 PROCESS FOR PREPARING MICROCAPSULES FIRMENICH SA (CH) 2020-11-26 WO disclosed
WO-2020127749-A1 PROCESS FOR PREPARING POLYAMIDE MICROCAPSULES FIRMENICH SA (CH) 2020-06-25 WO disclosed
WO-2020127743-A1 POLYAMIDE MICROCAPSULES FIRMENICH SA (CH) 2020-06-25 WO disclosed
EP-1249446-B1 Use of thio derivates as flavoring ingredients FIRMENICH & CIE (CH) 2007-03-07 EP disclosed
US-7008919-B2 Use of thio derivatives as perfuming and flavoring ingredients FIRMENICH SA (CH) 2006-03-07 US disclosed
US-20030040460-A1 Use of thio derivatives as perfuming and flavoring ingredients FIRMENICH SA (CH) 2003-02-27 US disclosed
EP-1249446-A2 Use of thio derivates as perfuming and flavoring ingredients FIRMENICH SA (CH) 2002-10-16 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 (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-20030040460-A1 Use of thio derivatives as perfuming and flavoring ingredients TAS2R1, TAS2R4, TAS1R1 ALDH1A1 166/4885TSHR 1235/4885

“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.