SCHEMBL1246945

SCHEMBL1246945

CC(C)CCOC(O)CC(C)C

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
ALDH1A1 P00352 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
SCHEMBL11445080 0.76 TSHR (0.34) ALDH1A1
SCHEMBL1983147 0.76
SCHEMBL10707401 0.76
SCHEMBL24593010 0.75 ODC1 (0.33)
SCHEMBL497155 0.75 DNM1 (0.41) CA12CA1CA2CA9ALDH1A1
SCHEMBL6318442 0.75 TDP1 (0.35) CA12CA1CA2CA9ALDH1A1
SCHEMBL9668195 0.74 ALDH1A1 (0.31) ALDH1A1
SCHEMBL13717820 0.74
SCHEMBL27350439 0.74 CA12 (0.39) CA12CA1CA2CA9ALDH1A1
SCHEMBL23165888 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9212123-B2 Cosmetic composition obtained by esterification of amyl alcohol or an isomer thereof and a natural vegetable oil fatty acid CHI, Jun-Hong (KR) 2015-12-15 US claimed
US-20150299092-A1 COSMETIC COMPOSITION OBTAINED BY ESTERIFICATION OF AMYL ALCOHOL OR AN ISOMER THEREOF AND A NATURAL VEGETABLE OIL FATTY ACID CHI, Jun-Hong (KR) 2015-10-22 US claimed
EP-2767271-A2 COSMETIC COMPOSITION OBTAINED BY ESTERIFICATION OF AMYL ALCOHOL OR AN ISOMER THEREOF AND A NATURAL VEGETABLE OIL FATTY ACID Chi, Jun-Hong (KR) 2014-08-20 EP claimed
US-7956208-B2 Preparation of platinum (II) complexes PLATCO TECHNOLOGIES (PROPRIETARY) LIMITED (ZA) 2011-06-07 US claimed
US-10844247-B2 Adhesive article backing with sorbent material 3M INNOVATIVE PROPERTIES COMPANY (US) 2020-11-24 US disclosed
CN-110325640-A Plum surprise yeast kind for compound biosynthesis 创新生物科学公司 2019-10-11 CN disclosed
US-20190002736-A1 ADHESIVE ARTICLE LINER WITH SORBENT MATERIAL 3M INNOVATIVE PROPERTIES COMPANY (US) 2019-01-03 US disclosed
US-20180362811-A1 ADHESIVE ARTICLES THAT INCLUDE A POLYMER FOAM AND METHODS OF MAKING THE SAME 3M INNOVATIVE PROPERTIES COMPANY 2018-12-20 US disclosed
US-20180355218-A1 ADHESIVE ARTICLE BACKING WITH SORBENT MATERIAL 3M INNOVATIVE PROPERTIES COMPANY 2018-12-13 US disclosed
US-20130183471-A1 LINER FOR PROTECTION OF ADHESIVES TESA SE (DE) 2013-07-18 US disclosed
US-8394186-B2 Porphyrazine coloring matter, ink composition and colored product NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2013-03-12 US disclosed
US-20110090278-A1 Porphyrazine Coloring Matter, Ink Composition And Colored Product NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-04-21 US disclosed
EP-2183236-B1 HYDROXYMETHYLFURFURAL ETHERS AND ESTERS PREPARED IN IONIC LIQUIDS FURANIX TECHNOLOGIES BV (NL) 2011-02-16 EP disclosed
US-5025110-A Alcohol reaction media for production of hexabromocyclododecane ETHYL CORPORATION (US) 1991-06-18 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 (1 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-20150299092-A1 COSMETIC COMPOSITION OBTAINED BY ESTERIFICATION OF AMYL ALCOHOL OR AN ISOMER THEREOF AND A NATURAL VEGETABLE OIL FATTY ACID ABHD6, FASN, ELOVL6 CA12 887/4885CA1 2255/4885CA2 2591/4885

“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.