SCHEMBL1472438

SCHEMBL1472438

CCCCC(CC)C1OCCO1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.48
ALDH1A1 P00352 5/20 0.37
EPHX1 P07099 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
TSHR P16473 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP3A4 P08684 1/20 0.31
DNM1 Q05193 2/20 0.31
CA2 P00918 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL30710203 1.00 THRB (0.48) THRBALDH1A1EPHX1TDP1TSHR
SCHEMBL15560285 0.92 THRB (0.42) THRBALDH1A1EPHX1DNM1
SCHEMBL18944397 0.86 THRB (0.36) THRB
SCHEMBL2101563 0.85 EPHX1 (0.41) THRBALDH1A1EPHX1DNM1CA2
SCHEMBL20145830 0.83 ALDH1A1 (0.39) THRBALDH1A1EPHX1TDP1
SCHEMBL10529314 0.83 THRB (0.36) THRB
SCHEMBL15187792 0.83 THRB (0.36) THRB
SCHEMBL25086738 0.83 EPHX1 (0.42) THRBALDH1A1EPHX1TSHRDNM1
SCHEMBL21689831 0.83 EPHX1 (0.42) THRBALDH1A1EPHX1TSHRDNM1
SCHEMBL2103885 0.83 EPHX1 (0.42) THRBALDH1A1EPHX1TSHRDNM1

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 141 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
CN-116490160-A A mixture containing 1, 2-alkanediol 西姆莱斯股份公司 2023-07-25 CN claimed
EP-4096618-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS Symrise AG (DE) 2022-12-07 EP claimed
US-20220364016-A1 PERFUME OIL MIXTURE SYMRISE AG (DE) 2022-11-17 US claimed
WO-2022122143-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS SYMRISE AG (DE) 2022-06-16 WO claimed
US-20190155975-A9 Antiperspirant and Deodorant Compositions Comprising Malodor Reduction Compositions THE PROCTER & GAMBLE COMPANY 2019-05-23 US claimed
EP-2555742-B2 ENCAPSULATES PROCTER & GAMBLE (US) 2018-12-05 EP claimed
US-10113140-B2 Freshening compositions and devices comprising same THE PROCTER & GAMBLE COMPANY (US) 2018-10-30 US claimed
US-9023783-B2 Encapsulates THE PROCTER & GAMBLE COMPANY (US) 2015-05-05 US claimed
US-20140342969-A1 ENCAPSULATES PROCTER & GAMBLE (US) 2014-11-20 US claimed
US-8822402-B2 Encapsulates THE PROCTER & GAMBLE COMPANY (US) 2014-09-02 US claimed
US-8633148-B2 Encapsulates THE PROCTER & GAMBLE COMPANY (US) 2014-01-21 US claimed
EP-2555742-A1 ENCAPSULATES The Procter & Gamble Company (US) 2013-02-13 EP claimed
EP-2556139-A1 ENCAPSULATES The Procter & Gamble Company (US) 2013-02-13 EP claimed
WO-2011127030-A1 ENCAPSULATES THE PROCTER & GAMBLE COMPANY (US) 2011-10-13 WO claimed
WO-2011127011-A1 ENCAPSULATES THE PROCTER & GAMBLE COMPANY (US) 2011-10-13 WO claimed
US-20110245134-A1 ENCAPSULATES PROCTER & GAMBLE COMPANY, THE 2011-10-06 US claimed
US-20110245136-A1 ENCAPSULATES PROCTER & GAMBLE COMPANY, THE 2011-10-06 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 (1 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-20240050337-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS OR10J3, OR51E2, MAL2 THRB 3399/4885ALDH1A1 27/4885EPHX1 1836/4885

“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.