SCHEMBL5524057

SCHEMBL5524057

CCCC1(OC(=O)C2CC=CCC2C(=O)O)CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 8/20 0.40
MAPK1 P28482 1/20 0.36
ALDH1A1 P00352 6/20 0.36
KDM4E B2RXH2 3/20 0.36
TSHR P16473 2/20 0.35
NPSR1 Q6W5P4 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
TDP1 Q9NUW8 6/20 0.32
RAB9A P51151 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 3/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CHD1L Q86WJ1 1/20 0.31
PARP9 Q8IXQ6 1/20 0.31

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
SCHEMBL5524059 0.94 MEN1 (0.32) POLBTSHRMEN1KMT2A
SCHEMBL5519049 0.92 POLB (0.44) POLBMAPK1ALDH1A1KDM4ETSHR
SCHEMBL5530957 0.89 POLB (0.38) POLBMAPK1ALDH1A1KDM4ETSHR
SCHEMBL5519055 0.86 POLB (0.35) POLBMAPK1MEN1KMT2A
SCHEMBL2381371 0.83 PEPD (0.33) ALDH1A1KDM4ESMN1; SMN2HSD17B10
SCHEMBL5515711 0.82 ALDH1A1 (0.35) POLBMAPK1ALDH1A1KDM4ETSHR
SCHEMBL5530960 0.82 MEN1 (0.33) ALDH1A1MEN1KMT2A
SCHEMBL2381368 0.79 CYP3A4 (0.34) MAPK1ALDH1A1KDM4ETSHRNPSR1
SCHEMBL5518257 0.78 ALDH1A1 (0.41) POLBALDH1A1KDM4ETSHRNPSR1
SCHEMBL5520500 0.76 POLB (0.35) POLBMAPK1ALDH1A1KDM4ETSHR

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 3 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-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 893/4885MAPK1 2408/4885ALDH1A1 3078/4885

“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.