SCHEMBL523326

SCHEMBL523326

CCCCCCOC(=O)O

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.64
EPHX1 P07099 1/20 0.59
HCAR2 Q8TDS4 2/20 0.59
TSHR P16473 3/20 0.57
RAD52 P43351 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
ALDH1A1 P00352 2/20 0.52
DGKA P23743 1/20 0.52
ACHE P22303 6/20 0.52
FAAH O00519 1/20 0.52
LMNA P02545 1/20 0.52

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
SCHEMBL1014736 1.00 NAAA (0.64) NAAAEPHX1HCAR2TSHRRAD52
SCHEMBL1835020 1.00 NAAA (0.64) NAAAEPHX1HCAR2TSHRRAD52
SCHEMBL1835071 1.00 NAAA (0.64) NAAAEPHX1HCAR2TSHRRAD52
SCHEMBL1833011 1.00 NAAA (0.64) NAAAEPHX1HCAR2TSHRRAD52
SCHEMBL1832879 1.00 NAAA (0.64) NAAAEPHX1HCAR2TSHRRAD52
SCHEMBL1836119 1.00 NAAA (0.64) NAAAEPHX1HCAR2TSHRRAD52
SCHEMBL1254240 1.00 NAAA (0.64) NAAAEPHX1HCAR2TSHRRAD52
SCHEMBL1255545 1.00 NAAA (0.64) NAAAEPHX1HCAR2TSHRRAD52
SCHEMBL1837716 1.00 NAAA (0.64) NAAAEPHX1HCAR2TSHRRAD52
SCHEMBL1835360 1.00 NAAA (0.64) NAAAEPHX1HCAR2TSHRRAD52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024245992-A1 IMPLANT FOR EYE UNIVERSITEIT MAASTRICHT (NL) 2024-12-05 WO claimed
CN-118271820-A Polycarbonate diol modified polycarbonate matrix composite material and preparation method thereof 厦门天宇新材料科技有限公司 2024-07-02 CN claimed
CN-118108921-A Biocompatible and biostable polydimethylsiloxane polyurethane urea with chain extension of urea-based chain extender, preparation and application 北京理工大学 2024-05-31 CN claimed
CN-116855214-A Polyurethane hot melt adhesive for outdoor sport functional fabric and preparation method thereof 东莞聚力创新材料科技有限公司 2023-10-10 CN claimed
CN-115584235-B PUR adhesive for clothing fabric and preparation method thereof 东莞聚力创新材料科技有限公司 2023-08-08 CN claimed
CN-113478795-B Preparation method of phase difference compensation optical film 沈勇 2023-05-23 CN claimed
CN-115651157-A Preparation method of high-performance integrated polyurethane elastomer auxetic material 北京化工大学 2023-01-31 CN claimed
CN-115584120-A Preparation method of polyurethane elastomer composite material with negative Poisson ratio property 北京化工大学 2023-01-10 CN claimed
CN-113478795-A Method for preparing phase difference compensation optical film 沈勇 2021-10-08 CN claimed
WO-2021058159-A1 PRODUCT FOR DYEING KERATINOUS MATERIAL, CONTAINING AMINOSILICONE, A CHROMOPHORIC COMPOUND AND AN ORGANIC CARBONIC ACID ESTER HENKEL AG & CO. KGAA (DE) 2021-04-01 WO claimed
US-7625943-B2 5-alkyl-7-alkylcarbonate-isoflavone ester and related method ROBERTS WILLIAM J 2009-12-01 US claimed
CN-1997675-A Olefin polymerization process in the presence of a radical generating system INNOVENE INC (US) 2007-07-11 CN claimed
US-20070092801-A1 Molten Salt Electrolyte for a Battery and Electrochemical Capacitor NANO-ELECTROCHEM, INC. 2007-04-26 US claimed
US-20050113354-A1 Bioavailable prodrugs of androgenic steroids and related method ROBERTS WILLIAM J (US) 2005-05-26 US claimed
US-20050065354-A1 5-alkyl-7-alkylcarbonate-isoflavone ester and related method ROBERTS WILLIAM J (US) 2005-03-24 US claimed
US-6818668-B2 ADMINISTERING PRODRUGS OF METABOLITES SUCH AS 5-METHYL-7-ETHYL CARBONATE-ISOFLAVONE, TO INCREASING CONCENTRATION OF FLAVONOIDS BIOTEST LABORATORIES, LLC 2004-11-16 US claimed
US-6740646-B2 Bioavailable prodrugs of androgenic steroids and related method BIOTEST LABORATORIES, LLC 2004-05-25 US claimed
WO-2003087083-A1 5-ALKYL-7-ALKYLCARBONATE-ISOFLAVONE ESTER AS ISOFLAVONE PRODRUG BIOTEST LABORATORIES, LLC (US) 2003-10-23 WO claimed
US-20030195245-A1 5-alkyl-7-alkylcarbonate-isoflavone ester and related method BIOTEST LABORATORIES, LLC 2003-10-16 US claimed
US-20030134830-A1 Bioavailable prodrugs of androgenic steroids and related method BIOTEST LABORATORIES, LLC 2003-07-17 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 (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-20030195245-A1 5-alkyl-7-alkylcarbonate-isoflavone ester and related method CYP2A7, CYP8B1, CYP3A7 NAAA 517/4885EPHX1 1230/4885HCAR2 198/4885
US-20050065354-A1 5-alkyl-7-alkylcarbonate-isoflavone ester and related method CYP2A7, CYP8B1, CYP3A7 NAAA 519/4885EPHX1 1245/4885HCAR2 194/4885

“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.