SCHEMBL822099

SCHEMBL822099

C=C(O)Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.55
CES2 O00748 1/20 0.55
AKR1B1 P15121 1/20 0.55
TSHR P16473 1/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
CALM1 P0DP23 1/20 0.45
FNTA P49354 1/20 0.44
FNTB P49356 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPK1 P28482 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CTBP2 P56545 1/20 0.43
EPHX2 P34913 1/20 0.43
THRB P10828 1/20 0.42
IDO1 P14902 1/20 0.42
PAM P19021 2/20 0.41

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
Acetic Acid SCHEMBL22129746 0.86 CES1 (0.54) CES1CES2AKR1B1TSHRMEN1
SCHEMBL13659245 0.85 LMNA (0.61) TSHRMEN1KMT2AALDH1A1IDO1
SCHEMBL12095508 0.82 CES1 (0.55) CES1CES2AKR1B1TSHRMEN1
SCHEMBL2241627 0.82 CES1 (0.55) CES1CES2AKR1B1TSHRMEN1
SCHEMBL10659309 0.81 ALDH1A1 (0.39) CES1CES2AKR1B1TSHRALDH1A1
SCHEMBL1333665 0.80 CES1 (0.52) CES1CES2AKR1B1TSHRMEN1
SCHEMBL3855307 0.80 CES1 (0.52) CES1CES2AKR1B1TSHRMEN1
SCHEMBL6077860 0.80 CES1 (0.52) CES1CES2AKR1B1TSHRMEN1
Ammonia Solution, Strong SCHEMBL574785 0.80 CES1 (0.52) CES1CES2AKR1B1TSHRMEN1
SCHEMBL15196522 0.79 MAOA (0.51) MEN1KMT2ATDP1ALDH1A1L3MBTL1

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 183 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
CN-115427421-B 3' -Ketoglycoside compounds for slow release of volatile alcohols 格莱克科学有限公司 2025-04-01 CN claimed
US-12234253-B2 Silicone compounds with a substituted amine group and a benefit agent moiety THE PROCTER & GAMBLE COMPANY (US) 2025-02-25 US claimed
US-20250051370-A1 SILICONE COMPOUNDS PROCTER & GAMBLE (US) 2025-02-13 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
CN-115279206-A Flavor composition 弗门尼舍有限公司 2022-11-01 CN claimed
US-20220064191-A1 SILICONE COMPOUNDS PROCTER & GAMBLE (US) 2022-03-03 US 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
US-20160137674-A1 SILICONE COMPOUNDS THE PROCTER & GAMBLE COMPANY 2016-05-19 US claimed
WO-2016077513-A1 SILICONE COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2016-05-19 WO 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
CN-101371830-A Medicament for inhibiting endothelial cell of cerebral vessels to secrete prostaglandin E2 TRADITIONAL CHINESE MEDICINE I (CN) 2009-02-25 CN claimed
US-4148995-A FROM AN AZETIDINONE AND A FURANONE, MULTISTEP Petrzilka, Theodor (CH) 1979-04-10 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 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-20160137674-A1 SILICONE COMPOUNDS SMCHD1, SRI, SMS CES1 1297/4885CES2 127/4885AKR1B1 3564/4885
US-20160137952-A1 COMPOUNDS FOR A CONTROLLED RELEASE OF ACTIVE MOLECULES UGT1A3, GUSB, UGT1A4 CES1 118/4885CES2 19/4885AKR1B1 143/4885
US-20250051370-A1 SILICONE COMPOUNDS SMCHD1, SRI, SMS CES1 1297/4885CES2 127/4885AKR1B1 3564/4885
US-20230183284-A1 3'-KETOGLYCOSIDE COMPOUND FOR THE SLOW RELEASE OF A VOLATILE ALCOHOL ADH1C, UGCG, ST6GAL1 CES1 160/4885CES2 231/4885AKR1B1 144/4885
US-12234253-B2 Silicone compounds with a substituted amine group and a benefit agent moiety SMS, SRM, AAAS CES1 2048/4885CES2 142/4885AKR1B1 3316/4885
US-12509482-B2 3′-ketoglycoside compound for the slow release of a volatile alcohol EBP, MGAT1, MGAT3 CES1 109/4885CES2 252/4885AKR1B1 176/4885
US-20220064191-A1 SILICONE COMPOUNDS SMCHD1, SRI, SMS CES1 1297/4885CES2 127/4885AKR1B1 3564/4885
US-20170088793-A1 COMPOUNDS FOR A CONTROLLED RELEASE OF ACTIVE MOLECULES UGT1A3, GUSB, UGT1A4 CES1 118/4885CES2 19/4885AKR1B1 143/4885

“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.