SCHEMBL645127

SCHEMBL645127

CCC(=O)CC(=O)CCc1ccc(O)c(OC)c1

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.89
OR51E2 Q9H255 1/20 0.89
CYP3A4 P08684 5/20 0.67
CYP2C8 P10632 5/20 0.67
CYP2C9 P11712 5/20 0.67
CYP2B6 P20813 5/20 0.67
CYP2C19 P33261 5/20 0.67
CYP1A2 P05177 4/20 0.67
LTA4H P09960 3/20 0.59
TRPV1 Q8NER1 3/20 0.59
IAPP P10997 1/20 0.59
HTR1A P08908 3/20 0.58
CYP2D6 P10635 3/20 0.58
CYP2A6 P11509 3/20 0.58
CYP2E1 P05181 2/20 0.58
TAAR1 Q96RJ0 2/20 0.56
TSHR P16473 1/20 0.56
MAPK1 P28482 1/20 0.56
POLB P06746 1/20 0.56
GAA P10253 1/20 0.56

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
Tetrahydrocurcumin SCHEMBL29372158 0.94 ALOX5 (1.00) ALOX5OR51E2CYP3A4CYP2C8CYP2C9
Tetrahydrocurcumin SCHEMBL284877 0.94 ALOX5 (1.00) ALOX5OR51E2CYP3A4CYP2C8CYP2C9
Tetrahydrocurcumin SCHEMBL29370299 0.94 ALOX5 (1.00) ALOX5OR51E2CYP3A4CYP2C8CYP2C9
SCHEMBL12775013 0.93 ALOX5 (0.80) ALOX5OR51E2CYP3A4CYP2C8CYP2C9
SCHEMBL10307817 0.90 ALOX5 (0.91) ALOX5OR51E2CYP3A4CYP2C8CYP2C9
SCHEMBL10307533 0.90 ALOX5 (0.91) ALOX5OR51E2CYP3A4CYP2C8CYP2C9
Tetrahydrodemethoxycurcumin SCHEMBL29565582 0.89 ALOX5 (0.89) ALOX5OR51E2CYP3A4CYP2C8CYP2C9
Tetrahydrodemethoxycurcumin SCHEMBL4413210 0.89 ALOX5 (0.89) ALOX5OR51E2CYP3A4CYP2C8CYP2C9
SCHEMBL10307751 0.89 ALOX5 (0.89) ALOX5OR51E2CYP3A4CYP2C8CYP2C9
SCHEMBL28355932 0.88 ALOX5 (0.88) ALOX5OR51E2CYP3A4CYP2C8CYP2C9

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-1901618-B1 HYDROXYPHENYLALKADIONES AND THEIR USE FOR MASKING BITTER TASTE AND/OR FOR INTENSIFYING SWEET TASTE SYMRISE GMBH & CO KG (DE) 2009-06-17 EP claimed
US-20080227866-A1 Hydroxyphenylalkadiones and Their Use for Masking Bitter Taste and/or for Intensifying Sweet Taste SYMRISE GMBH & CO. KG (DE) 2008-09-18 US claimed
EP-1901618-A1 HYDROXYPHENYLALKADIONES AND THEIR USE FOR MASKING BITTER TASTE AND/OR FOR INTENSIFYING SWEET TASTE Symrise GmbH & Co. KG (DE) 2008-03-26 EP claimed
WO-2007003527-A1 HYDROXYPHENYLALKADIONES AND THEIR USE FOR MASKING BITTER TASTE AND/OR FOR INTENSIFYING SWEET TASTE SYMRISE GMBH & CO. KG (DE) 2007-01-11 WO claimed
CN-116178125-A Tetrahydrocurcumin derivative and preparation method and application thereof 南方医科大学 2023-05-30 CN disclosed
CN-110261496-B Method for detecting content of tetrahydrocurcumin 四川省中医药科学院 2022-04-05 CN disclosed
US-8119696-B2 Treatment of superficial and cutaneous mycoses with a pure form of 1,7-bis(4-hydroxy-3-methoxyphenyl)-3,5-heptanedione Majeed, Muhammed (US) 2012-02-21 US disclosed
US-20090275665-A1 Enhanced biological potential of greater than 99% pure form of 1, 7-bis(4-hydroxy-3-methoxyphenyl)-3,5-heptanedione over corresponding 95% pure form-therapeutic and agricultural applications thereof SAMI LABS LIMITED (IN) 2009-11-05 US disclosed
EP-1901618-B1 HYDROXYPHENYLALKADIONES AND THEIR USE FOR MASKING BITTER TASTE AND/OR FOR INTENSIFYING SWEET TASTE SYMRISE GMBH & CO KG (DE) 2009-06-17 EP disclosed
EP-1901618-B1 HYDROXYPHENYLALKADIONES AND THEIR USE FOR MASKING BITTER TASTE AND/OR FOR INTENSIFYING SWEET TASTE SYMRISE GMBH & CO KG (DE) 2009-06-17 EP disclosed
US-20080227866-A1 Hydroxyphenylalkadiones and Their Use for Masking Bitter Taste and/or for Intensifying Sweet Taste SYMRISE GMBH & CO. KG (DE) 2008-09-18 US disclosed
US-20080227866-A1 Hydroxyphenylalkadiones and Their Use for Masking Bitter Taste and/or for Intensifying Sweet Taste SYMRISE GMBH & CO. KG (DE) 2008-09-18 US disclosed
US-20080227866-A1 Hydroxyphenylalkadiones and Their Use for Masking Bitter Taste and/or for Intensifying Sweet Taste SYMRISE GMBH & CO. KG (DE) 2008-09-18 US disclosed
WO-2008042755-A2 INHIBITORS OF COGNITIVE DECLINE COGNITION THERAPEUTICS, INC. (US) 2008-04-10 WO disclosed
EP-1901618-A1 HYDROXYPHENYLALKADIONES AND THEIR USE FOR MASKING BITTER TASTE AND/OR FOR INTENSIFYING SWEET TASTE Symrise GmbH & Co. KG (DE) 2008-03-26 EP disclosed
WO-2007003527-A1 HYDROXYPHENYLALKADIONES AND THEIR USE FOR MASKING BITTER TASTE AND/OR FOR INTENSIFYING SWEET TASTE SYMRISE GMBH & CO. KG (DE) 2007-01-11 WO disclosed
WO-2007003527-A1 HYDROXYPHENYLALKADIONES AND THEIR USE FOR MASKING BITTER TASTE AND/OR FOR INTENSIFYING SWEET TASTE SYMRISE GMBH & CO. KG (DE) 2007-01-11 WO 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 (2 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-20090275665-A1 Enhanced biological potential of greater than 99% pure form of 1, 7-bis(4-hydroxy-3-methoxyphenyl)-3,5-heptanedione over corresponding 95% pure form-therapeutic and agricultural applications thereof CYP8B1, HPD, HAAO ALOX5 268/4885OR51E2 906/4885CYP3A4 94/4885
US-20080227866-A1 Hydroxyphenylalkadiones and Their Use for Masking Bitter Taste and/or for Intensifying Sweet Taste TAS2R1, TAS2R5, TAS2R50 ALOX5 1881/4885OR51E2 30/4885CYP3A4 2811/4885

“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.