SCHEMBL406229

SCHEMBL406229

CC=C(C)C(=O)OCCC=CCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 2/20 0.39
NR1I2 O75469 2/20 0.39
PTGS2 P35354 2/20 0.39
PGR P06401 1/20 0.39
PDE4D Q08499 1/20 0.39
ALDH1A1 P00352 6/20 0.37
CYP19A1 P11511 4/20 0.37
PPARG P37231 3/20 0.37
OXER1 Q8TDS5 3/20 0.37
MAPT P10636 3/20 0.37
RXRA P19793 2/20 0.37
FFAR1 O14842 2/20 0.37
CYP3A4 P08684 2/20 0.37
ALOX15 P16050 2/20 0.37
HSD17B10 Q99714 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
TSHR P16473 1/20 0.37
LPAR2 Q9HBW0 3/20 0.36
LPAR3 Q9UBY5 3/20 0.36
LPAR1 Q92633 1/20 0.36

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
SCHEMBL406228 1.00 ADORA3 (0.39) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL872853 1.00 ADORA3 (0.39) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL3383981 1.00 ADORA3 (0.39) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL4631039 1.00 ADORA3 (0.39) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL1532457 1.00 ADORA3 (0.39) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL1771437 1.00 ADORA3 (0.39) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL9933295 1.00 ADORA3 (0.39) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL21485374 1.00 ADORA3 (0.39) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL21485375 1.00 ADORA3 (0.39) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL1868201 0.93 ALDH1A1 (0.37) ADORA3NR1I2PTGS2PGRPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4096618-B1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS SYMRISE AG (DE) 2025-01-29 EP claimed
EP-4438065-A2 A MIXTURE COMPRISING 1,2-ALKANEDIOLS Symrise AG (DE) 2024-10-02 EP claimed
US-20240050337-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS SYMRISE AG (DE) 2024-02-15 US claimed
US-20220364016-A1 PERFUME OIL MIXTURE SYMRISE AG (DE) 2022-11-17 US claimed
US-20120021959-A1 Muttiple Use Fabric Conditioning Composition With Blooming Perfume MORGAN III GEORGE KAVIN (US) 2012-01-26 US claimed
US-8058224-B2 Comprising fabric conditioning component and carrier and blooming perfume composition comprising at least 25%, by weight, of perfume ingredients having boiling points equal to or lower than 250 degrees C.; wherein composition is operably connectable to inside surface of dryer THE PROCTER & GAMBLE COMPANY (US) 2011-11-15 US claimed
JP-4813379-B2 2011-11-09 JP claimed
US-20080311054-A1 Compositions and Methods to Counteract Oral Malodour GIVAUDAN SA (CH) 2008-12-18 US claimed
EP-1999244-A1 DRYER-ADDED FABRIC CARE ARTICLES The Procter and Gamble Company (US) 2008-12-10 EP claimed
US-20080247966-A1 Compositions and Methods to Counteract Oral Malodour GIVAUDAN SA (CH) 2008-10-09 US claimed
EP-0991327-B1 MICROORGANISM REDUCTION METHODS AND COMPOSITIONS FOR FOOD CLEANING PROCTER & GAMBLE (US) 2004-12-01 EP claimed
EP-1383547-A2 AIR FRESHENING COMPOSITIONS, ARTICLES COMPRISING SAME AND METHODS FOR PREPARING SAME THE PROCTER & GAMBLE COMPANY (US) 2004-01-28 EP claimed
US-20030036489-A1 Consumable composition comprising perfumed particles and article containing the same THE PROCTER & GAMBLE COMPANY 2003-02-20 US claimed
US-20030024997-A1 Air freshening compositions, articles comprising same and methods THE PROCTER & GAMBLE COMPANY 2003-02-06 US claimed
WO-2002089862-A2 AIR FRESHENING COMPOSITIONS, ARTICLES COMPRISING SAME AND METHODS FOR PREPARING SAME THE PROCTER & GAMBLE COMPANY (US) 2002-11-14 WO claimed
WO-2002090479-A1 PERFUMED PARTICLES AND ARTICLES CONTAINING THE SAME THE PROCTER & GAMBLE COMPANY (US) 2002-11-14 WO claimed
US-6455086-B1 BASIC FOOD CLEANING COMPOSITIONS USING FOOD COMPATIBLE INGREDIENTS FOR TREATING FOOD SUCH AS PRODUCE, E.G., FRUITS AND VEGETABLES, AND EDIBLE ANIMAL PROTEINS ARE PROVIDED WITH SPECIFIC NON-SUBSTANTIVE PERFUME. LIQUID AND SOLID POWDER THE PROCTER & GAMBLE COMPANY 2002-09-24 US claimed
CN-1268874-A Method and composition for cleaning food products to reduce microorganisms PROCTER & GAMBLE (US) 2000-10-04 CN claimed
EP-0991327-A1 MICROORGANISM REDUCTION METHODS AND COMPOSITIONS FOR FOOD CLEANING THE PROCTER & GAMBLE COMPANY (US) 2000-04-12 EP claimed
WO-1999000025-A1 MICROORGANISM REDUCTION METHODS AND COMPOSITIONS FOR FOOD CLEANING THE PROCTER & GAMBLE COMPANY (US) 1999-01-07 WO 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 (3 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-20080311054-A1 Compositions and Methods to Counteract Oral Malodour TAS2R60, TAS2R40, LPO ADORA3 3656/4885NR1I2 2892/4885PTGS2 2606/4885
US-20030024997-A1 Air freshening compositions, articles comprising same and methods PIEZO1, TMEM63A, KIT ADORA3 501/4885NR1I2 4571/4885PTGS2 903/4885
US-20240050337-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS OR10J3, OR51E2, MAL2 ADORA3 3157/4885NR1I2 1698/4885PTGS2 1353/4885

“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.