SCHEMBL5523213

SCHEMBL5523213

CC(C)CCCCCCCCCCCOC(=O)C1CC=CCC1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.38
PPARG P37231 4/20 0.37
MAPK1 P28482 1/20 0.37
RARB P10826 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
ESR1 P03372 1/20 0.34
GAA P10253 1/20 0.33
TSHR P16473 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
SCHEMBL5518240 1.00 POLB (0.38) POLBPPARGMAPK1RARBSMN1; SMN2
SCHEMBL5515437 1.00 POLB (0.38) POLBPPARGMAPK1RARBSMN1; SMN2
SCHEMBL5518938 1.00 POLB (0.38) POLBPPARGMAPK1RARBSMN1; SMN2
SCHEMBL5519794 1.00 POLB (0.38) POLBPPARGMAPK1RARBSMN1; SMN2
SCHEMBL5524523 1.00 POLB (0.38) POLBPPARGMAPK1RARBSMN1; SMN2
SCHEMBL5518900 1.00 POLB (0.38) POLBPPARGMAPK1RARBSMN1; SMN2
SCHEMBL5513689 1.00 POLB (0.38) POLBPPARGMAPK1RARBSMN1; SMN2
SCHEMBL5524561 1.00 POLB (0.38) POLBPPARGMAPK1RARBSMN1; SMN2
SCHEMBL5519154 1.00 POLB (0.38) POLBPPARGMAPK1RARBSMN1; SMN2
SCHEMBL5511929 1.00 POLB (0.38) POLBPPARGMAPK1RARBSMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-7271282-B1 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester NEW JAPAN CHEMICAL CO., LTD. (JP) 2007-09-18 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
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

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 POLB 893/4885PPARG 99/4885MAPK1 2408/4885

“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.