SCHEMBL1997874

SCHEMBL1997874

CC1=C(C=CC(C)O)C(C)(C)CCC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.57
ALDH1A1 P00352 9/20 0.51
PTGS1 P23219 4/20 0.51
LMNA P02545 2/20 0.51
DRD3 P35462 2/20 0.51
SLCO1B3 Q9NPD5 1/20 0.51
SLCO1B1 Q9Y6L6 1/20 0.51
HAO1 Q9UJM8 1/20 0.49
RXRA P19793 6/20 0.47
CYP3A4 P08684 5/20 0.47
APP P05067 4/20 0.47
SNCA P37840 4/20 0.47
ALOX15 P16050 3/20 0.47
TSHR P16473 2/20 0.47
TP53 P04637 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
NR2E1 Q9Y466 1/20 0.47
MAPT P10636 6/20 0.45
RARA P10276 4/20 0.45
RARB P10826 4/20 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
SCHEMBL891562 1.00 CYP1A2 (0.57) CYP1A2ALDH1A1PTGS1LMNADRD3
SCHEMBL11472130 1.00 CYP1A2 (0.57) CYP1A2ALDH1A1PTGS1LMNADRD3
SCHEMBL21198720 0.87 CYP1A2 (0.46) CYP1A2ALDH1A1PTGS1LMNADRD3
SCHEMBL13749295 0.83 CYP1A2 (0.53) CYP1A2ALDH1A1PTGS1LMNADRD3
SCHEMBL7643377 0.82 CYP1A2 (0.53) CYP1A2ALDH1A1PTGS1LMNADRD3
SCHEMBL3504278 0.82 CYP1A2 (0.53) CYP1A2ALDH1A1PTGS1LMNADRD3
SCHEMBL1183480 0.81 CYP1A2 (0.37) CYP1A2ALDH1A1PTGS1LMNADRD3
Iodide SCHEMBL11765922 0.81 CYP1A2 (0.51) CYP1A2ALDH1A1PTGS1LMNADRD3
Iodide SCHEMBL11765926 0.81 CYP1A2 (0.51) CYP1A2ALDH1A1PTGS1LMNADRD3
SCHEMBL11671414 0.81 ALDH1A1 (0.73) CYP1A2ALDH1A1PTGS1LMNADRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4711010-A2 PRO-PERFUME COMPOSITIONS Firmenich SA (CH) 2026-03-18 EP claimed
US-12509482-B2 3′-ketoglycoside compound for the slow release of a volatile alcohol GLYCOSCIENCE, S.L. (ES) 2025-12-30 US claimed
US-20230183284-A1 3'-KETOGLYCOSIDE COMPOUND FOR THE SLOW RELEASE OF A VOLATILE ALCOHOL GLYCOSCIENCE, S.L. (ES) 2023-06-15 US claimed
EP-4103576-A1 3'-KETOGLYCOSIDE COMPOUND FOR THE SLOW RELEASE OF A VOLATILE ALCOHOL Glycoscience, S.L. (ES) 2022-12-21 EP claimed
WO-2021160670-A1 3'-KETOGLYCOSIDE COMPOUND FOR THE SLOW RELEASE OF A VOLATILE ALCOHOL GLYCOSCIENCE, S.L. (ES) 2021-08-19 WO claimed
EP-3011000-B1 COMPOUNDS FOR A CONTROLLED RELEASE OF ACTIVE MOLECULES FIRMENICH & CIE (CH) 2017-08-09 EP claimed
US-20170088793-A1 COMPOUNDS FOR A CONTROLLED RELEASE OF ACTIVE MOLECULES FIRMENICH SA (CH) 2017-03-30 US claimed
US-9550960-B2 Compounds for a controlled release of active molecules FIRMENICH SA (CH) 2017-01-24 US claimed
US-20160137952-A1 COMPOUNDS FOR A CONTROLLED RELEASE OF ACTIVE MOLECULES FIRMENICH SA (CH) 2016-05-19 US claimed
EP-3011000-A1 COMPOUNDS FOR A CONTROLLED RELEASE OF ACTIVE MOLECULES Firmenich SA (CH) 2016-04-27 EP claimed
WO-2014202416-A1 COMPOUNDS FOR A CONTROLLED RELEASE OF ACTIVE MOLECULES FIRMENICH SA (CH) 2014-12-24 WO claimed
WO-1990003113-A1 ATTRACTANCE FOR DACUS LATIFRONS, THE MALAYSIAN FRUIT FLY THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, UNITED STATES DEPARTMENT OF COMMERCE (US) 1990-04-05 WO claimed
US-4877607-A CYCLOHEXYL AND CYCLOHEXENYL ALIPHATIC ALCOHOLS AND KETONES THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1989-10-31 US claimed
EP-4711010-A2 PRO-PERFUME COMPOSITIONS Firmenich SA (CH) 2026-03-18 EP disclosed
US-20260022140-A1 3'-KETOGLYCOSIDE COMPOUND FOR THE SLOW RELEASE OF A VOLATILE ALCOHOL GLYCOSCIENCE, S.L. (ES) 2026-01-22 US disclosed
US-12509482-B2 3′-ketoglycoside compound for the slow release of a volatile alcohol GLYCOSCIENCE, S.L. (ES) 2025-12-30 US disclosed
US-4672068-A Antihypertensive 1,4-dihydropyridines having a conjugated ester FUJIREBIO KABUSHIKI KAISHA (JP) 1987-06-09 US disclosed
US-4605675-A Polyene compounds useful in the treatment of allergic responses USV PHARMACEUTICAL CORP. (US) 1986-08-12 US disclosed
EP-0161877-A2 1,4-dihydropyridine derivatives, methods for their production and pharmaceutical compositions comprising the same FUJIREBIO KABUSHIKI KAISHA also trading as FUJIREBIO INC. (JP) 1985-11-21 EP disclosed
US-4026910-A Oxidation process using nickel peroxide oxidizing agents HOFFMANN-LA ROCHE INC. (US) 1977-05-31 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 (5 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-20260022140-A1 3'-KETOGLYCOSIDE COMPOUND FOR THE SLOW RELEASE OF A VOLATILE ALCOHOL GPR35, DPY30, ERG28 CYP1A2 1632/4885ALDH1A1 2451/4885PTGS1 801/4885
US-20160137952-A1 COMPOUNDS FOR A CONTROLLED RELEASE OF ACTIVE MOLECULES UGT1A3, GUSB, UGT1A4 CYP1A2 26/4885ALDH1A1 62/4885PTGS1 565/4885
US-20230183284-A1 3'-KETOGLYCOSIDE COMPOUND FOR THE SLOW RELEASE OF A VOLATILE ALCOHOL ADH1C, UGCG, ST6GAL1 CYP1A2 835/4885ALDH1A1 670/4885PTGS1 1010/4885
US-12509482-B2 3′-ketoglycoside compound for the slow release of a volatile alcohol EBP, MGAT1, MGAT3 CYP1A2 1628/4885ALDH1A1 952/4885PTGS1 1101/4885
US-20170088793-A1 COMPOUNDS FOR A CONTROLLED RELEASE OF ACTIVE MOLECULES UGT1A3, GUSB, UGT1A4 CYP1A2 26/4885ALDH1A1 62/4885PTGS1 565/4885

“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.