SCHEMBL3394207

SCHEMBL3394207

CCCCC(CC)COC(CC(=O)O)(CC(CC)CCCC)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.44
TSHR P16473 3/20 0.44
ATM Q13315 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 6/20 0.40
CA2 P00918 3/20 0.40
MMP9 P14780 1/20 0.39
MMP8 P22894 1/20 0.39
MMP14 P50281 1/20 0.39
RECQL P46063 1/20 0.38
LMNA P02545 3/20 0.36
MAPK1 P28482 2/20 0.36
HSD17B10 Q99714 1/20 0.36
HSPD1 P10809 1/20 0.35
BLM P54132 1/20 0.35
HSPE1 P61604 1/20 0.35
PRSS1 P07477 1/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35

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
SCHEMBL6558757 0.87 HSPD1 (0.43) RECQLLMNAHSD17B10HSPD1BLM
SCHEMBL15361849 0.86 HSPD1 (0.44) RECQLLMNAHSD17B10HSPD1BLM
SCHEMBL3075596 0.81 CYP3A4 (0.41) CYP3A4TSHRATMTDP1L3MBTL1
SCHEMBL192180 0.80 CYP3A4 (0.44) CYP3A4TSHRATMTDP1L3MBTL1
SCHEMBL27960834 0.79 CYP3A4 (0.46) CYP3A4TSHRATMTDP1L3MBTL1
SCHEMBL27893103 0.79 CYP3A4 (0.40) CYP3A4TSHRATMTDP1L3MBTL1
SCHEMBL11171832 0.77 CYP3A4 (0.38) CYP3A4TSHRATMTDP1L3MBTL1
SCHEMBL11293025 0.77 CYP3A4 (0.45) CYP3A4TSHRATMTDP1L3MBTL1
SCHEMBL30402681 0.75 CYP3A4 (0.39) CYP3A4TSHRATMTDP1L3MBTL1
SCHEMBL44319 0.75 CA2 (0.47) CYP3A4TSHRATMTDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
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-4263180-A1 METHOD FOR OBTAINING NITROCELLULOSE-BASED STRUCTURES BY MEANS OF ADDITIVE MANUFACTURING Eurenco (FR) 2023-10-25 EP disclosed
US-11597695-B2 Method of preparing hydroxyalkylcarboxylic acid esters BASF SE (DE) 2023-03-07 US disclosed
WO-2022129771-A1 METHOD FOR OBTAINING NITROCELLULOSE-BASED STRUCTURES BY MEANS OF ADDITIVE MANUFACTURING EURENCO (FR) 2022-06-23 WO disclosed
EP-3526190-B1 METHOD OF PREPARING HYDROXYALKYLCARBOXYLIC ACID ESTERS BASF SE (DE) 2021-09-15 EP disclosed
US-20200048180-A1 METHOD OF PREPARING HYDROXYALKYLCARBOXYLIC ACID ESTERS BASF PERSONAL CARE AND NUTRITION GMBH (DE) 2020-02-13 US disclosed
EP-3526190-A1 METHOD OF PREPARING HYDROXYALKYLCARBOXYLIC ACID ESTERS BASF SE (DE) 2019-08-21 EP disclosed
WO-2018069372-A1 METHOD OF PREPARING HYDROXYALKYLCARBOXYLIC ACID ESTERS BASF SE (DE) 2018-04-19 WO disclosed
EP-2554049-B1 Herbicidal composition with improved efficiency, preparation method and use ARD SA (FR) 2016-03-02 EP disclosed
US-20030103915-A1 Combinations of sunscreens 3V SIGMA S.P.A. (IT) 2003-06-05 US disclosed
EP-1300137-A2 Combinations of sunscreens 3V SIGMA S.p.A (IT) 2003-04-09 EP disclosed
US-6537530-B2 Film-forming agent, solvent, suspending agent, adhesion promoter selected from tosylamide epoxy resin, adipic acid neopental glycol trimellitic anhydride copolymer, phthalic anhydride trimellitic anhydride glycol copolymer, plasticizer TEVCO, INC. 2003-03-25 US disclosed
US-6514485-B1 Combinations of sunscreens 3V SIGMA S.P.A. (IT) 2003-02-04 US disclosed
US-20020176830-A1 Phthalate free nail polish enamel composition employing novel plasticizers TEVCO ENTERPRISES, INC. 2002-11-28 US disclosed
US-20020103280-A1 Malic acid diester surfactants LASSILA KEVIN RODNEY (US) 2002-08-01 US disclosed
WO-2002058644-A1 PHTHALATE FREE NAIL POLISH ENAMEL COMPOSITION EMPLOYING NOVEL PLASTICIZERS TEVCO, INC. (US) 2002-08-01 WO disclosed
US-6369146-B1 AN AQUEOUS ORGANIC COATING COMPRISING A RESIN, SURFACTANT, WETTING AGENT, FLOW AND LEVELING AGENTS AND AN HYDROXY DIALKYL(C3-6) MALEATE; REDUCED EQUILIBRIUM AND DYNAMIC SURFACE TENSION; COATINGS; INKS; ADHESIVES; HERBICIDES AIR PRODUCTS AND CHEMICALS, INC. 2002-04-09 US disclosed
EP-1095988-A2 Malic acid diester surfactants AIR PRODUCTS AND CHEMICALS, INC. (US) 2001-05-02 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 (4 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-20200048180-A1 METHOD OF PREPARING HYDROXYALKYLCARBOXYLIC ACID ESTERS ADH1C, ADH1A, ELOVL6 CYP3A4 285/4885TSHR 2857/4885ATM 4379/4885
US-11597695-B2 Method of preparing hydroxyalkylcarboxylic acid esters ADH1C, ADH1A, ELOVL6 CYP3A4 285/4885TSHR 2857/4885ATM 4379/4885
US-20030103915-A1 Combinations of sunscreens ERCC4, ERCC1, ERCC5 CYP3A4 1718/4885TSHR 4610/4885ATM 564/4885
US-20020176830-A1 Phthalate free nail polish enamel composition employing novel plasticizers POLR1C, PIK3C3, ETF1 CYP3A4 2589/4885TSHR 4319/4885ATM 2721/4885

“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.