SCHEMBL1617090

SCHEMBL1617090

CC(C)=CCC/C(C)=C\C(C)O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.56
MEN1 O00255 2/20 0.52
CYP3A4 P08684 2/20 0.52
ALOX15 P16050 2/20 0.52
KDM4E B2RXH2 3/20 0.52
MAPT P10636 2/20 0.50
ALDH1A1 P00352 2/20 0.50
UGT1A1 P22309 1/20 0.50
SQLE Q14534 5/20 0.48
ATM Q13315 1/20 0.47
FNTA P49354 1/20 0.46
FNTB P49356 1/20 0.46
POLB P06746 1/20 0.45
TSHR P16473 1/20 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
SCHEMBL808086 1.00 KMT2A (0.56) KMT2AMEN1CYP3A4ALOX15KDM4E
SCHEMBL1616971 1.00 KMT2A (0.56) KMT2AMEN1CYP3A4ALOX15KDM4E
SCHEMBL11305714 0.87 KMT2A (0.53) KMT2AMEN1CYP3A4ALOX15KDM4E
SCHEMBL11705342 0.87 KMT2A (0.53) KMT2AMEN1CYP3A4ALOX15KDM4E
SCHEMBL11584608 0.84 KMT2A (0.58) KMT2AMEN1CYP3A4ALOX15KDM4E
SCHEMBL356392 0.84 KMT2A (0.58) KMT2AMEN1CYP3A4ALOX15KDM4E
SCHEMBL22167140 0.84 KMT2A (0.58) KMT2AMEN1CYP3A4ALOX15KDM4E
SCHEMBL11586065 0.84 KMT2A (0.58) KMT2AMEN1CYP3A4ALOX15KDM4E
SCHEMBL28140446 0.83 KDM4E (0.37) KMT2AMEN1CYP3A4ALOX15KDM4E
SCHEMBL794967 0.83 KMT2A (0.52) KMT2AMEN1CYP3A4ALOX15KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2948534-B1 USE OF 4,8-DIMETHYL-3,7-NONADIEN-2-OL AS A PERFUME BASF SE (DE) 2017-03-15 EP claimed
US-9217121-B2 Use of 4,8 dimethyl-3,7 nonadien-2-ol as fragrance BASF SE (DE) 2015-12-22 US claimed
EP-2948534-A1 USE OF 4,8-DIMETHYL-3,7-NONADIEN-2-OL AS PERFUME BASF SE (DE) 2015-12-02 EP claimed
US-20140213494-A1 USE OF 4,8 DIMETHYL-3,7 NONADIEN-2-OL AS FRAGRANCE BASF SE (DE) 2014-07-31 US claimed
WO-2014114733-A1 USE OF 4,8-DIMETHYL-3,7-NONADIEN-2-OL AS PERFUME BASF SE (DE) 2014-07-31 WO claimed
US-11958859-B2 Use of pyridoxal acetal salts as water-triggered pro-fragrances FLORIDA GULF COAST UNIVERSITY BOARD OF TRUSTEES (US) 2024-04-16 US disclosed
US-20240108040-A1 HIGH INTENSITY SWEETENERS FIRMENICH INCORPORATED (US) 2024-04-04 US disclosed
EP-3743410-B1 USE OF PYRIDOXAL ACETAL SALTS AS WATER-TRIGGERED PROFRAGRANCES FLORIDA GULF COAST UNIV BOARD OF TRUSTEES (US) 2023-10-25 EP disclosed
EP-3416729-B1 PRO-FRAGRANCE COMPOSITION AQDOT LTD (GB) 2023-09-20 EP disclosed
US-11758933-B2 High intensity sweeteners FIRMENICH INCORPORATED (US) 2023-09-19 US disclosed
EP-3368542-B1 HIGH INTENSITY SWEETENERS FIRMENICH INCORPORATED (US) 2022-06-22 EP disclosed
CN-108601958-B Pro-fragrance compositions 爱客多有限公司 2022-06-17 CN disclosed
EP-1417896-A1 Fruit, berry, cranberry and hedonically-stable citrus flavored compositions and process for preparing same INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2004-05-12 EP disclosed
US-20030096731-A1 Aromas and aroma compositions containing 4,8-dimethyl-3,7-nonadien-2-one, and a method for production thereof SYMRISE AG (DE) 2003-05-22 US disclosed
EP-1248532-A1 AROMAS AND AROMA COMPOSITIONS CONTAINING 4,8-DIMETHYL-3,7-NONADIEN-2-ONE Symrise GmbH & Co. KG (DE) 2002-10-16 EP disclosed
EP-1161517-A1 PERFUMED LIQUID HOUSEHOLD CLEANING, FABRIC TREATMENT AND DEODORIZING COMPOSITIONS PACKAGED IN MODIFIED POLYETHYLENE BOTTLES The Procter & Gamble Company (US) 2001-12-12 EP disclosed
US-20010005711-A1 Perfume compositions comprising 4,8-dimethyl-3,7-nonadien-2-one SYMRISE GMBH & CO. KG (DE) 2001-06-28 US disclosed
EP-1111029-A2 Perfume compositions containing 4,8-dimethyl-3,7-nonadien-2-one HAARMANN & REIMER GMBH (DE) 2001-06-27 EP disclosed
WO-2001043567-A1 AROMAS AND AROMA COMPOSITIONS CONTAINING 4,8-DIMETHYL-3,7-NONADIEN-2-ONE, AND A METHOD FOR THE PRODUCTION THEREOF HAARMANN & REIMER GMBH (DE) 2001-06-21 WO disclosed
WO-2000055292-A1 PERFUMED LIQUID HOUSEHOLD CLEANING FABRIC TREATMENT AND DEODORIZING COMPOSITIONS PACKAGED IN POLYETHYLENE BOTTLES MODIFIED TO PRESERVE PERFUME INTEGRITY THE PROCTER & GAMBLE COMPANY (US) 2000-09-21 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 (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-20030096731-A1 Aromas and aroma compositions containing 4,8-dimethyl-3,7-nonadien-2-one, and a method for production thereof TAS2R8, TAS2R7, TAS2R40 KMT2A 28/4885MEN1 599/4885CYP3A4 820/4885
US-20010005711-A1 Perfume compositions comprising 4,8-dimethyl-3,7-nonadien-2-one DEK, DPM1, DEGS1 KMT2A 1772/4885MEN1 1837/4885CYP3A4 289/4885
US-20240108040-A1 HIGH INTENSITY SWEETENERS TAS2R40, TAS2R60, TAS1R1 KMT2A 2697/4885MEN1 2644/4885CYP3A4 4332/4885
US-11958859-B2 Use of pyridoxal acetal salts as water-triggered pro-fragrances PLPBP, PNPO, ADH5 KMT2A 3491/4885MEN1 3308/4885CYP3A4 283/4885
US-11758933-B2 High intensity sweeteners TAS2R40, TAS2R60, TAS1R1 KMT2A 2697/4885MEN1 2644/4885CYP3A4 4332/4885

“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.