SCHEMBL2472477

SCHEMBL2472477

CCCCCc1ccc(CNC(=O)c2ccc(CN(C(=O)CCC3CCCC3)c3ccc(C(=O)O)c(O)c3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 14/20 0.46
SLC6A4 P31645 2/20 0.42
PDK1 Q15118 1/20 0.42
LTB4R2 Q9NPC1 1/20 0.42
PPARA Q07869 1/20 0.42
PTPN2 P17706 1/20 0.41
PTPN1 P18031 1/20 0.41
PTPRS Q13332 1/20 0.41

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
SCHEMBL2469102 0.94 STAT3 (0.54) STAT3SLC6A4PDK1LTB4R2
SCHEMBL13711669 0.86 STAT3 (0.50) STAT3SLC6A4LTB4R2
SCHEMBL2468215 0.85 KAT8 (0.47) STAT3SLC6A4
SCHEMBL5142598 0.84 SLC6A4 (0.44) STAT3SLC6A4LTB4R2
SCHEMBL1733846 0.84 PTPN11 (0.51) STAT3
SCHEMBL13711620 0.83 STAT3 (0.63) STAT3LTB4R2PPARA
SCHEMBL13513440 0.83 STAT3 (0.52) STAT3SLC6A4
SCHEMBL1733819 0.81 STAT3 (0.49) STAT3
SCHEMBL2470498 0.81 STAT3 (0.57) STAT3PDK1PPARA
SCHEMBL2472681 0.80 STAT3 (0.64) STAT3PDK1LTB4R2

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-1656139-B1 ARYL DICARBOXAMIDES MERCK SERONO SA (CH) 2011-10-05 EP claimed
US-7365225-B2 Aryl dicarboxamides LABORATOIRES SERONO SA (CH) 2008-04-29 US claimed
US-20060189583-A1 Aryl dicarboxamides MERCK SERONO SA (CH) 2006-08-24 US claimed
EP-1656139-B1 ARYL DICARBOXAMIDES MERCK SERONO SA (CH) 2011-10-05 EP disclosed
EP-1656139-B1 ARYL DICARBOXAMIDES MERCK SERONO SA (CH) 2011-10-05 EP disclosed
US-7365225-B2 Aryl dicarboxamides LABORATOIRES SERONO SA (CH) 2008-04-29 US disclosed
US-7365225-B2 Aryl dicarboxamides LABORATOIRES SERONO SA (CH) 2008-04-29 US disclosed
US-7365225-B2 Aryl dicarboxamides LABORATOIRES SERONO SA (CH) 2008-04-29 US disclosed
US-20060189583-A1 Aryl dicarboxamides MERCK SERONO SA (CH) 2006-08-24 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-20060189583-A1 Aryl dicarboxamides GPR119, PTPRS, ECHS1 STAT3 3402/4885SLC6A4 2469/4885PDK1 78/4885

“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.