SCHEMBL3190353

SCHEMBL3190353

CCCCCCCCCC(CCCCCCCC)C(CCCCCCCC)(CCCCCCCC)C(=O)OCCCCCCCC

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.44
EPHX1 P07099 1/20 0.42
TSHR P16473 3/20 0.41
ZDHHC7 Q9NXF8 1/20 0.40
FDPS P14324 1/20 0.40
HCAR2 Q8TDS4 1/20 0.39
RAD52 P43351 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
FAAH O00519 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
ACHE P22303 5/20 0.38

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
SCHEMBL19664738 1.00 NAAA (0.44) NAAAEPHX1TSHRZDHHC7FDPS
SCHEMBL5665395 1.00 NAAA (0.44) NAAAEPHX1TSHRZDHHC7FDPS
SCHEMBL2117715 1.00 NAAA (0.44) NAAAEPHX1TSHRZDHHC7FDPS
SCHEMBL2119181 1.00 NAAA (0.44) NAAAEPHX1TSHRZDHHC7FDPS
SCHEMBL20531189 1.00 NAAA (0.44) NAAAEPHX1TSHRZDHHC7FDPS
SCHEMBL28065732 0.92 FDPS (0.42) NAAAEPHX1TSHRZDHHC7FDPS
SCHEMBL28110101 0.92 FDPS (0.42) NAAAEPHX1TSHRZDHHC7FDPS
SCHEMBL28117806 0.92 FDPS (0.42) NAAAEPHX1TSHRZDHHC7FDPS
SCHEMBL7868971 0.86 NAAA (0.43) NAAAEPHX1TSHRZDHHC7FDPS
SCHEMBL7555878 0.84 NAAA (0.42) NAAAEPHX1TSHRZDHHC7HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114599339-A Solid anhydrous composition for caring for and/or making up keratin materials 莱雅公司 2022-06-07 CN claimed
WO-2021081876-A1 SOLID ANHYDROUS COMPOSITION FOR CARING FOR AND/OR MAKING UP KERATIN MATERIALS L'OREAL (FR) 2021-05-06 WO claimed
EP-2651370-B1 COSMETIC COMPOSITION COMPRISING A SUPRAMOLECULAR COMPOUND CAPABLE OF ESTABLISHING HYDROGEN BONDS, A SILICONE OIL AND A WAX OREAL (FR) 2018-11-14 EP claimed
EP-2723309-B1 COSMETIC COMPOSITION COMPRISING A SUPRAMOLECULAR COMPOUND CAPABLE OF ESTABLISHING HYDROGEN BONDS, AND TWO PARTICULAR DISTINCT SILICONE OILS OREAL (FR) 2018-10-17 EP claimed
EP-2512428-B1 COSMETIC COMPOSITION COMPRISING A SUPRAMOLECULAR COMPOUND CAPABLE OF ESTABLISHING HYDROGEN BONDS, AND A PARTICULAR OIL L'ORÉAL (FR) 2017-04-05 EP claimed
US-9504856-B2 Composition containing a compound capable of establishing hydrogen bonds, and cosmetic treatment process L'OREAL (FR) 2016-11-29 US claimed
EP-2512427-B1 COSMETIC COMPOSITION COMPRISING A SUPRAMOLECULAR COMPOUND CAPABLE OF ESTABLISHING HYDROGEN BONDS, AND A PARTICULAR ADDITIONAL INGREDIENT OREAL (FR) 2013-11-06 EP claimed
EP-2651370-A2 COSMETIC COMPOSITION COMPRISING A SUPRAMOLECULAR COMPOUND CAPABLE OF ESTABLISHING HYDROGEN BONDS, A SILICONE OIL AND A WAX L'Oréal (FR) 2013-10-23 EP claimed
WO-2012080165-A2 COSMETIC COMPOSITION COMPRISING A SUPRAMOLECULAR COMPOUND CAPABLE OF ESTABLISHING HYDROGEN BONDS, A SILICONE OIL AND A WAX L'OREAL (FR) 2012-06-21 WO claimed
CN-114599339-A Solid anhydrous composition for caring for and/or making up keratin materials 莱雅公司 2022-06-07 CN disclosed
US-11045409-B2 Composition comprising a water-insoluble solid organic UV-screening agent and a compound capable of establishing hydrogen bonds L'OREAL (FR) 2021-06-29 US disclosed
WO-2021081876-A1 SOLID ANHYDROUS COMPOSITION FOR CARING FOR AND/OR MAKING UP KERATIN MATERIALS L'OREAL (FR) 2021-05-06 WO disclosed
EP-3019143-B1 COMPOSITION COMPRISING A WATER-INSOLUBLE SOLID ORGANIC UV-SCREENING AGENT AND A COMPOUND CAPABLE OF ESTABLISHING HYDROGEN BONDS OREAL (FR) 2019-03-13 EP disclosed
EP-2651370-B1 COSMETIC COMPOSITION COMPRISING A SUPRAMOLECULAR COMPOUND CAPABLE OF ESTABLISHING HYDROGEN BONDS, A SILICONE OIL AND A WAX OREAL (FR) 2018-11-14 EP disclosed
US-20130136705-A1 COSMETIC COMPOSITION COMPRISING AN OIL AND A POLYMER BOTH BEARING A HYDROGEN-BOND-GENERATING JOINING GROUP, AND COSMETIC TREATMENT PROCESS L'OREAL (FR) 2013-05-30 US disclosed
EP-2575751-A1 COSMETIC COMPOSITION COMPRISING AN OIL AND A POLYMER BOTH BEARING A HYDROGEN-BOND-GENERATING JOINING GROUP, AND COSMETIC TREATMENT PROCESS L'Oréal (FR) 2013-04-10 EP disclosed
US-20130022561-A1 COSMETIC COMPOSITION COMPRISING A SUPRAMOLECULAR COMPOUND CAPABLE OF ESTABLISHING HYDROGEN BONDS, AND A PARTICULAR OIL L'OREAL (FR) 2013-01-24 US disclosed
US-20130004438-A1 COSMETIC COMPOSITION COMPRISING A SUPRAMOLECULAR COMPOUND CAPABLE OF ESTABLISHING HYDROGEN BONDS, AND A PARTICULAR ADDITIONAL INGREDIENT L'OREAL (FR) 2013-01-03 US disclosed
WO-2012080165-A2 COSMETIC COMPOSITION COMPRISING A SUPRAMOLECULAR COMPOUND CAPABLE OF ESTABLISHING HYDROGEN BONDS, A SILICONE OIL AND A WAX L'OREAL (FR) 2012-06-21 WO disclosed
US-20100028277-A1 COMPOSITION CONTAINING A COMPOUND CAPABLE OF ESTABLISHING HYDROGEN BONDS, AND COSMETIC TREATMENT PROCESS L'OREAL (FR) 2010-02-04 US 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-20130136705-A1 COSMETIC COMPOSITION COMPRISING AN OIL AND A POLYMER BOTH BEARING A HYDROGEN-BOND-GENERATING JOINING GROUP, AND COSMETIC TREATMENT PROCESS SQLE, MMS19, FDFT1 NAAA 499/4885EPHX1 893/4885TSHR 3863/4885
US-11045409-B2 Composition comprising a water-insoluble solid organic UV-screening agent and a compound capable of establishing hydrogen bonds F2, F12, C1S NAAA 2812/4885EPHX1 291/4885TSHR 4333/4885
US-20130022561-A1 COSMETIC COMPOSITION COMPRISING A SUPRAMOLECULAR COMPOUND CAPABLE OF ESTABLISHING HYDROGEN BONDS, AND A PARTICULAR OIL TYR, C1R, TST NAAA 2363/4885EPHX1 1380/4885TSHR 1984/4885
US-20100028277-A1 COMPOSITION CONTAINING A COMPOUND CAPABLE OF ESTABLISHING HYDROGEN BONDS, AND COSMETIC TREATMENT PROCESS CUTA, ALOX15, DSG1 NAAA 866/4885EPHX1 121/4885TSHR 4599/4885
US-20130004438-A1 COSMETIC COMPOSITION COMPRISING A SUPRAMOLECULAR COMPOUND CAPABLE OF ESTABLISHING HYDROGEN BONDS, AND A PARTICULAR ADDITIONAL INGREDIENT FDFT1, ESD, SCO2 NAAA 2300/4885EPHX1 1797/4885TSHR 2557/4885

“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.