SCHEMBL6053170

SCHEMBL6053170

O=C(O)CCCCCCCCCCC(=O)C1CCOC1=O

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
TSHR P16473 1/20 0.41
NFKB1 P19838 1/20 0.41
PMP22 Q01453 1/20 0.41
F13A1 P00488 3/20 0.37
GPR84 Q9NQS5 1/20 0.36

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
SCHEMBL8761365 0.81
SCHEMBL7930137 0.81
SCHEMBL8761317 0.81
SCHEMBL535005 0.81 LMNA (0.46) LMNA
SCHEMBL534980 0.77 HSD17B10 (0.43)
SCHEMBL9147304 0.76 TDP1 (0.40) LMNATSHRNFKB1PMP22
SCHEMBL25344550 0.76 NAAA (0.36) GPR84
SCHEMBL9145691 0.74 FOLH1 (0.37)
SCHEMBL16321314 0.72
SCHEMBL535753 0.72 KDM4E (0.37)

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0970952-B1 PROCESSES FOR PREPARING 2-OMEGA-ALKOXYCARBONYLALKANOYL)-4-BUTANOLIDES, OMEGA-HYDROXY-OMEGA-3)-KETO FATTY ESTERS, AND DERIVATIVES THEREOF SODA AROMATIC COMPANY LTD (JP) 2006-08-09 EP disclosed
US-6600070-B2 Chemical intermediates for large cyclic lactone-based perfumes, formed by condensation reaction of gamma-butyrolactone with a dicarboxylate ester SODA AROMATIC CO., LTD. (JP) 2003-07-29 US disclosed
US-6528668-B2 Perfumes TORAY INDUSTRIES, INC. (JP) 2003-03-04 US disclosed
US-6475133-B2 Methods for making 2-(ω-alkoxycarbonylalkanoyl)-4-butanolide, ester of omega-hydroxy-(ω-3)-ketoaliphatic acid, and derivatives thereof SODA AROMATIC CO., LTD. (JP) 2002-11-05 US disclosed
US-20020133028-A1 Methods for making 2-(omega-alkoxycarbonylalkanoyl) -4-butanolide, ester of omega-Hydroxy-(omega-3) -ketoaliphatic acid, and derivatives thereof SODA AROMATIC CO., LTD. 2002-09-19 US disclosed
US-20020068832-A1 Methods for making 2-(omega-alkoxycarbonylalkanoyl) -4-butanolide, ester of omega-hydroxy - ( omega-3 ) -ketoaliphatic acid, and derivatives thereof SODA AROMATIC CO., LTD. 2002-06-06 US disclosed
US-20010051734-A1 Methods for making 2-(omega-alkoxycarbonylalkanoyl) -4-butanolide, ester of omega-hydroxy- (omega-3) - ketoaliphatic acid, and derivatives thereof SODA AROMATIC CO., LTD. 2001-12-13 US disclosed
US-6291688-B1 CONDENSING .GAMMA.-BUTYROLACTONE WITH A DICARBOXYLATE ESTER BY HEATING AND STIRRING TO FORM 2-(.OMEGA.-ALKOXYCARBONYLALKANOYL)-4-BUTANOLIDE AND ITS ALKALI METAL SALT SODA AROMATIC CO., LTD. (JP) 2001-09-18 US disclosed
EP-0970952-A1 PROCESSES FOR PREPARING 2-($g(v)-ALKOXYCARBONYLALKANOYL)-4-BUTANOLIDES, $g(v)-HYDROXY-($g(v)-3)-KETO FATTY ESTERS, AND DERIVATIVES THEREOF SODA AROMATIC COMPANY, LIMITED (JP) 2000-01-12 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 (3 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-20020133028-A1 Methods for making 2-(omega-alkoxycarbonylalkanoyl) -4-butanolide, ester of omega-Hydroxy-(omega-3) -ketoaliphatic acid, and derivatives thereof SCD, FFAR3, ELOVL3 LMNA 1218/4885TSHR 2354/4885NFKB1 1137/4885
US-20010051734-A1 Methods for making 2-(omega-alkoxycarbonylalkanoyl) -4-butanolide, ester of omega-hydroxy- (omega-3) - ketoaliphatic acid, and derivatives thereof SCD, ELOVL3, HACD3 LMNA 1332/4885TSHR 2482/4885NFKB1 1165/4885
US-20020068832-A1 Methods for making 2-(omega-alkoxycarbonylalkanoyl) -4-butanolide, ester of omega-hydroxy - ( omega-3 ) -ketoaliphatic acid, and derivatives thereof SCD, ELOVL3, HACD3 LMNA 1332/4885TSHR 2482/4885NFKB1 1165/4885

“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.