SCHEMBL1628643

SCHEMBL1628643

C/C=C/C(=O)OCCCC(C)CCC=C(C)C

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.56
ALDH1A1 P00352 1/20 0.45
USP2 O75604 1/20 0.45
ATM Q13315 1/20 0.39
EPHX2 P34913 1/20 0.37
NFE2L2 Q16236 1/20 0.37
HCAR2 Q8TDS4 3/20 0.35
TSHR P16473 1/20 0.35
PTPN1 P18031 1/20 0.35
GGPS1 O95749 2/20 0.33
FDPS P14324 2/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL5166720 0.91 ALOX15 (0.69) ALOX15ALDH1A1USP2EPHX2NFE2L2
SCHEMBL8661556 0.83 ALOX15 (0.75) ALOX15ALDH1A1USP2ATMEPHX2
SCHEMBL8153295 0.83 ALOX15 (0.75) ALOX15ALDH1A1USP2ATMEPHX2
SCHEMBL31126959 0.81 ALOX15 (0.63) ALOX15ALDH1A1USP2EPHX2NFE2L2
SCHEMBL8660314 0.78 ALOX15 (0.67) ALOX15ALDH1A1USP2ATMEPHX2
SCHEMBL4967684 0.77 ATM (0.48) ALDH1A1ATMHCAR2TSHRPTPN1
SCHEMBL4967675 0.77 ATM (0.48) ALDH1A1ATMHCAR2TSHRPTPN1
Crotonic Acid SCHEMBL28035376 0.77 ALOX15 (0.57) ALOX15ALDH1A1USP2EPHX2NFE2L2
Citronellol SCHEMBL28864543 0.77 ALOX15 (0.62) ALOX15ALDH1A1USP2NFE2L2HCAR2
SCHEMBL3193137 0.76 ALOX15 (0.75) ALOX15ALDH1A1USP2EPHX2NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3860553-A1 FATTY ALCOHOL-CONTAINING, ETHANOLIC SUNSCREEN WITH A REDUCED TENDENCY TO STAIN TEXTILES Beiersdorf AG (DE) 2021-08-11 EP claimed
EP-3761946-A1 FRUIT ACID-CONTAINING COSMETIC GEL Beiersdorf AG (DE) 2021-01-13 EP claimed
EP-3706612-A1 ANNULAR CLEANING CLOTH Beiersdorf AG (DE) 2020-09-16 EP claimed
EP-3651725-A1 SUNSCREEN WITH PROTECTION AGAINST TEXTILE SPOTTING DUE TO 2,4-BIS-{[4-(2-ETHYL-HEXYL-OXY)-2-HYDROXY]-PHENYL}-6-(4-METHOXYPHENYL)-1,3,5-TRIAZINE Beiersdorf AG (DE) 2020-05-20 EP claimed
EP-3651723-A1 SUNSCREEN WITH A PROTECTION AGAINST TEXTILE SPOTTING DUE TO 4-(TERT-BUTYL)-4´-METHOXYDIBENZOYLMETHANE Beiersdorf AG (DE) 2020-05-20 EP claimed
EP-3651724-A1 SUNSCREEN WITH PROTECTION AGAINST TEXTILE SPOTTING DUE TO HEXYL 2-[4-(DIETHYLAMINO)-2-HYDROXYBENZOYL]BENZOATES Beiersdorf AG (DE) 2020-05-20 EP claimed
WO-2020069838-A1 FATTY ALCOHOL-CONTAINING, ETHANOLIC SUNSCREEN WITH A REDUCED TENDENCY TO STAIN TEXTILES BEIERSDORF AG (DE) 2020-04-09 WO claimed
WO-2019170327-A1 FRUIT ACID-CONTAINING COSMETIC GEL BEIERSDORF AG (DE) 2019-09-12 WO claimed
EP-2308458-B1 PREPARATION FOR DAILY CARE CONTAINING OLEIC ACID BEIERSDORF AG (DE) 2018-08-08 EP claimed
EP-2185125-B1 COSMETIC EMULSIFIER COMBINATION BEIERSDORF AG (DE) 2018-02-21 EP claimed
EP-1997382-B1 Insect repellent based on emulsion BEIERSDORF AG (DE) 2017-09-20 EP claimed
CN-118576505-A Having diethylamino hydroxybenzoyl hexyl benzoate and butyl methoxy effective sunscreen compositions of dibenzoylmethane and devoid of octocrylene 巴斯夫欧洲公司 2024-09-03 CN disclosed
EP-3863597-A1 SUNSCREEN WITH A COMBINATION OF WAXES AND CETYL PALMITATE Beiersdorf AG (DE) 2021-08-18 EP disclosed
EP-3846770-A1 SAND-REPELLENT COSMETIC PREPARATIONS Beiersdorf AG (DE) 2021-07-14 EP disclosed
EP-3761946-A1 FRUIT ACID-CONTAINING COSMETIC GEL Beiersdorf AG (DE) 2021-01-13 EP disclosed
US-20180271771-A1 POLYURETHANEUREA SOLUTIONS FOR COMPOSITIONS WITH ACTIVE INGREDIENTS OR FRAGRANCES COVESTRO DEUTSCHLAND AG (DE) 2018-09-27 US disclosed
EP-3247325-A1 POLYURETHANEUREA SOLUTIONS FOR COMPOSITIONS WITH ACTIVE INGREDIENTS OR FRAGRANCES Covestro Deutschland AG (DE) 2017-11-29 EP disclosed
WO-2016116403-A1 POLYURETHANEUREA SOLUTIONS FOR COMPOSITIONS WITH ACTIVE INGREDIENTS OR FRAGRANCES COVESTRO DEUTSCHLAND AG (DE) 2016-07-28 WO disclosed
US-20110091400-A1 COSMETIC EMULSIFIER COMBINATION BEIERSDORF AG (DE) 2011-04-21 US disclosed
EP-1745772-A2 Insect repellents with improved activity Beiersdorf AG (DE) 2007-01-24 EP 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-20180271771-A1 POLYURETHANEUREA SOLUTIONS FOR COMPOSITIONS WITH ACTIVE INGREDIENTS OR FRAGRANCES PUF60, UFM1, UMPS ALOX15 804/4885ALDH1A1 141/4885USP2 52/4885
US-20110091400-A1 COSMETIC EMULSIFIER COMBINATION SPTSSB, GRIN2B, SUCLG2 ALOX15 643/4885ALDH1A1 514/4885USP2 1061/4885

“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.