SCHEMBL4669841

SCHEMBL4669841

CCCCCCc1ccc(C#Cc2ccc(CN(Cc3cccc(Cl)c3)C(=O)C(=O)O)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGES O14684 6/20 0.47
PTPN11 Q06124 1/20 0.46
PTPRO Q16827 1/20 0.46
FFAR1 O14842 2/20 0.41
FFAR4 Q5NUL3 1/20 0.41
SLC2A1 P11166 1/20 0.41
STAT3 P40763 1/20 0.40
AKR1C3 P42330 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MMP12 P39900 1/20 0.40

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
SCHEMBL1857817 0.90 FFAR1 (0.50) PTGESPTPN11PTPROFFAR1FFAR4
SCHEMBL4671737 0.89 MMP2 (0.49) PTGESPTPN11PTPROFFAR1FFAR4
SCHEMBL4967354 0.85 PTGES (0.42) PTGESPTPN11PTPROFFAR1FFAR4
SCHEMBL1855022 0.84 FFAR1 (0.49) PTGESPTPN11PTPROFFAR1FFAR4
SCHEMBL1853713 0.84 FFAR1 (0.49) PTGESPTPN11PTPROFFAR1FFAR4
SCHEMBL1853166 0.84 FFAR1 (0.49) PTGESPTPN11PTPROFFAR1FFAR4
SCHEMBL1852821 0.83 PTGES (0.59) PTGESPTPN11PTPROFFAR1AKR1C3
SCHEMBL1851285 0.82 PTPN11 (0.42) PTGESPTPN11PTPROFFAR1FFAR4
SCHEMBL6721403 0.81 PTPN11 (0.41) PTGESPTPN11PTPROFFAR1FFAR4
SCHEMBL4672519 0.79 PTPN11 (0.48) PTGESPTPN11PTPROFFAR1FFAR4

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 6 patents. 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
EP-1904048-A1 GLEPP-1 INHIBITORS IN THE TREATMENT OF AUTOIMMUNE AND/OR INFLAMMATORY DISORDERS LABORATOIRES SERONO S.A. (CH) 2008-04-02 EP claimed
WO-2007009959-A1 GLEPP-1 INHIBITORS IN THE TREATMENT OF AUTOIMMUNE AND/OR INFLAMMATORY DISORDERS LABORATOIRES SERONO S.A. (CH) 2007-01-25 WO claimed
US-20080207722-A1 Glepp-1 Inhibitors in the Treatment of Autoimmune and/or Inflammatory Disorders LABORATORIES SERONO SA (CH) 2008-08-28 US disclosed
EP-1904048-A1 GLEPP-1 INHIBITORS IN THE TREATMENT OF AUTOIMMUNE AND/OR INFLAMMATORY DISORDERS LABORATOIRES SERONO S.A. (CH) 2008-04-02 EP disclosed
WO-2007009959-A1 GLEPP-1 INHIBITORS IN THE TREATMENT OF AUTOIMMUNE AND/OR INFLAMMATORY DISORDERS LABORATOIRES SERONO S.A. (CH) 2007-01-25 WO 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-20080207722-A1 Glepp-1 Inhibitors in the Treatment of Autoimmune and/or Inflammatory Disorders PPP1R1B, PPP5C, PPP3CA PTGES 999/4885PTPN11 458/4885PTPRO 86/4885

“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.