SCHEMBL4670205

SCHEMBL4670205

CCCCc1ccc(C#Cc2ccc(CN(Cc3ccc(O)c(C(=O)O)c3)C(=O)C(C)C3CCCC3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.55
PTPRO Q16827 1/20 0.55
KAT8 Q9H7Z6 2/20 0.46
STAT3 P40763 3/20 0.44
UBLCP1 Q8WVY7 2/20 0.39
MCL1 Q07820 1/20 0.39
ACACB O00763 2/20 0.38
HNF4A P41235 1/20 0.37
PTGES O14684 5/20 0.37
PPARA Q07869 1/20 0.36
MMP2 P08253 1/20 0.36
MMP9 P14780 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
SCHEMBL4670215 0.83 PTPN11 (0.51) PTPN11PTPROSTAT3
SCHEMBL1736062 0.82 PTPN11 (0.55) PTPN11PTPROKAT8STAT3MCL1
SCHEMBL1734774 0.79 PTPN11 (0.66) PTPN11PTPROKAT8STAT3MCL1
SCHEMBL1734576 0.76 PTPN11 (0.62) PTPN11PTPROKAT8STAT3MCL1
SCHEMBL1734580 0.75 PTPN11 (0.69) PTPN11PTPROKAT8STAT3MCL1
SCHEMBL2848964 0.74 PTPN11 (0.60) PTPN11PTPROKAT8STAT3MCL1
SCHEMBL13711682 0.73 SLC6A4 (0.49) PTPN11PTPROKAT8STAT3MCL1
SCHEMBL1734725 0.72 PTPN11 (0.71) PTPN11PTPROKAT8STAT3PPARA
SCHEMBL1733827 0.71 PTPN11 (1.00) PTPN11PTPROKAT8STAT3MCL1
SCHEMBL1734802 0.71 PTPN11 (0.89) PTPN11PTPROKAT8STAT3MCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080207722-A1 Glepp-1 Inhibitors in the Treatment of Autoimmune and/or Inflammatory Disorders LABORATORIES SERONO SA (CH) 2008-08-28 US claimed

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-20080207722-A1 Glepp-1 Inhibitors in the Treatment of Autoimmune and/or Inflammatory Disorders PPP1R1B, PPP5C, PPP3CA PTPN11 458/4885PTPRO 86/4885KAT8 4198/4885

“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.