SCHEMBL2838414

SCHEMBL2838414

CC(C)CCCC(C)COC(=O)C1CCCCC1C(=O)OCC(C)CCCC(C)C

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40
BLM P54132 1/20 0.40
PTPN1 P18031 3/20 0.37
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.36
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRB3 P13945 1/20 0.33

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
SCHEMBL17797279 0.94 BLM (0.39) TP53CYP3A4BLMPTPN1GAA
SCHEMBL5523169 0.86 TRPM8 (0.37) BLMPTPN1LMNA
SCHEMBL3221339 0.86 BLM (0.42) TP53CYP3A4BLMPTPN1GAA
SCHEMBL5531046 0.84 BLM (0.33) BLMPTPN1LMNA
SCHEMBL29992266 0.83 BLM (0.44) TP53CYP3A4BLM
SCHEMBL1297282 0.83 TP53 (0.39) TP53CYP3A4GAARAB9ASMN1; SMN2
SCHEMBL5519027 0.83 BLM (0.39) CYP3A4BLMPTPN1GAALMNA
SCHEMBL1296803 0.81 TP53 (0.43) TP53CYP3A4GAARAB9ASMN1; SMN2
SCHEMBL1296856 0.81 TP53 (0.38) TP53CYP3A4GAARAB9ASMN1; SMN2
SCHEMBL234626 0.81 TP53 (0.48) TP53CYP3A4GAARAB9ASMN1; SMN2

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
US-20100144572-A1 Lubricants having alkyl cyclohexyl 1,2-dicarboxylates EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2010-06-10 US claimed
US-8614174-B2 Lubricants having alkyl cyclohexyl 1,2-dicarboxylates EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2013-12-24 US disclosed
US-20100144572-A1 Lubricants having alkyl cyclohexyl 1,2-dicarboxylates EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2010-06-10 US disclosed
US-7282601-B2 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester NEW JAPAN CHEMICAL CO., LTD. (JP) 2007-10-16 US disclosed
US-20050038283-A1 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester NEW JAPAN CHEMICAL, CO., LTD. (JP) 2005-02-17 US disclosed
US-6667285-B1 Branched-chain carboxylic acid monoalkyl ester with outstanding hydrolytic stability NEW JAPAN CHEMICAL CO., LTD. (JP) 2003-12-23 US disclosed
EP-1227078-A1 DICARBOXYLIC DIESTER, PROCESS FOR PRODUCING THE SAME, AND REFRIGERATING MACHINE LUBRICATING OIL COMPRISING THE ESTER NEW JAPAN CHEMICAL CO.,LTD. (JP) 2002-07-31 EP disclosed
EP-1225213-A1 LUBRICATING OIL FOR REFRIGERATOR, HYDRAULIC FLUID COMPOSITION FOR REFRIGERATOR AND METHOD FOR LUBRICATION OF REFRIGERATOR NEW JAPAN CHEMICAL CO.,LTD. (JP) 2002-07-24 EP disclosed
EP-1063279-A1 Refrigerator oil for carbon dioxide refrigerant, and method of using it for lubrication Idemitsu Kosan Co., Ltd. (JP) 2000-12-27 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 (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-20050038283-A1 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester SCO2, PDHX, DECR2 TP53 3031/4885CYP3A4 575/4885BLM 2289/4885

“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.