SCHEMBL4671671

SCHEMBL4671671

CCCCCCc1ccc(C#Cc2ccccc2CN(Cc2ccc(C(F)(F)F)cc2)C(=O)C(=O)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 10/20 0.46
PTGES O14684 1/20 0.44
PTPN11 Q06124 1/20 0.41
PTPRO Q16827 1/20 0.41
FFAR4 Q5NUL3 2/20 0.39
PLK1 P53350 1/20 0.39
FAAH O00519 1/20 0.38
CHRM2 P08172 1/20 0.38
S1PR1 P21453 1/20 0.38
FPR1 P21462 1/20 0.38
FPR3 P25089 1/20 0.38
GPR183 P32249 1/20 0.38
APLNR P35414 1/20 0.38
GPR65 Q8IYL9 1/20 0.38
SLC6A5 Q9Y345 1/20 0.37

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
SCHEMBL1733849 0.90 PTPN11 (0.48) FFAR1PTGESPTPN11PTPROFFAR4
SCHEMBL4672519 0.90 PTPN11 (0.48) FFAR1PTGESPTPN11PTPROFFAR4
SCHEMBL4314702 0.90 PTPN11 (0.48) FFAR1PTGESPTPN11PTPROFFAR4
SCHEMBL4965330 0.89 PTGES (0.47) FFAR1PTGESPTPN11PTPROFFAR4
SCHEMBL1857494 0.87 CYP3A4 (0.42) FFAR1PTGESFFAR4PLK1
SCHEMBL4671673 0.87 FFAR1 (0.45) FFAR1PTPN11PTPROFFAR4PLK1
SCHEMBL1853577 0.86 PTGES (0.47) FFAR1PTGESPTPN11PTPROFFAR4
SCHEMBL1852821 0.85 PTGES (0.59) FFAR1PTGESPTPN11PTPROPLK1
SCHEMBL1856809 0.84 FAAH (0.51) PLK1FAAHS1PR1
SCHEMBL1854444 0.83 PTGES (0.48) FFAR1PTGESPTPN11PTPRO

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 FFAR1 2136/4885PTGES 999/4885PTPN11 458/4885

“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.