SCHEMBL22767674

SCHEMBL22767674

O=C(O[C@H](Cc1ccc2ccccc2c1)C(=O)O)C(c1ccccc1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 13/20 0.55
PPARA Q07869 12/20 0.55
KLK7 P49862 2/20 0.44
SLC1A3 P43003 1/20 0.44
SLC1A2 P43004 1/20 0.44
SLC1A1 P43005 1/20 0.44
PPARD Q03181 1/20 0.43
MMP9 P14780 1/20 0.42
MMP8 P22894 1/20 0.42
MME P08473 1/20 0.42
ACE P12821 1/20 0.42
CPA1 P15085 1/20 0.42
ACE2 Q9BYF1 1/20 0.42

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
SCHEMBL24115494 0.87 PPARG (0.47) PPARGPPARAKLK7SLC1A3SLC1A2
SCHEMBL9554385 0.84 SRR (0.57) PPARGPPARAKLK7ACE
SCHEMBL22767763 0.81 PPARG (0.57) PPARGPPARASLC1A3SLC1A2SLC1A1
SCHEMBL22767860 0.80 PPARG (0.56) PPARGPPARASLC1A3SLC1A2SLC1A1
SCHEMBL22767761 0.79 PPARG (0.49) PPARGPPARASLC1A3SLC1A2SLC1A1
SCHEMBL15446174 0.79 SRR (0.68) PPARGPPARASLC1A3SLC1A2SLC1A1
SCHEMBL15446199 0.79 SRR (0.68) PPARGPPARASLC1A3SLC1A2SLC1A1
SCHEMBL22767931 0.77 PPARG (0.53) PPARGPPARASLC1A3SLC1A2SLC1A1
SCHEMBL26357303 0.77 SLC1A3 (0.62) PPARGPPARASLC1A3SLC1A2SLC1A1
SCHEMBL22767894 0.76 PPARG (0.59) PPARGPPARAPPARDACE

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-20240024266-A1 Therapeutic Agent or Prophylactic Agent for COVID-19 HIROSHIMA UNIVERSITY (JP) 2024-01-25 US disclosed
US-20240024266-A1 Therapeutic Agent or Prophylactic Agent for COVID-19 HIROSHIMA UNIVERSITY (JP) 2024-01-25 US disclosed
EP-4248997-A1 THERAPEUTIC AGENT OR PROPHYLACTIC AGENT FOR COVID-19 Hiroshima University (JP) 2023-09-27 EP disclosed
US-11203565-B2 Ester compound and PIN1 inhibitor, inflammatory disease therapeutic, and colon cancer therapeutic in which said ester compound is used HIROSHIMA UNIVERSITY (JP) 2021-12-21 US disclosed
US-11071738-B2 Therapeutic agent for fatty liver diseases and therapeutic agent for adiposity HIROSHIMA UNIVERSITY (JP) 2021-07-27 US disclosed
US-20200383989-A1 Therapeutic Agent for Fatty Liver Diseases and Therapeutic Agent for Adiposity HIROSHIMA UNIVERSITY (JP) 2020-12-10 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 (4 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-20200383989-A1 Therapeutic Agent for Fatty Liver Diseases and Therapeutic Agent for Adiposity FABP1, LIPC, SLC10A1 PPARG 29/4885PPARA 18/4885KLK7 1508/4885
US-11203565-B2 Ester compound and PIN1 inhibitor, inflammatory disease therapeutic, and colon cancer therapeutic in which said ester compound is used PIN1, APC, GSKIP PPARG 184/4885PPARA 262/4885KLK7 3561/4885
US-11071738-B2 Therapeutic agent for fatty liver diseases and therapeutic agent for adiposity FABP1, LIPC, SLC10A1 PPARG 29/4885PPARA 18/4885KLK7 1508/4885
US-20240024266-A1 Therapeutic Agent or Prophylactic Agent for COVID-19 PIN1, ACE2, ACE PPARG 1621/4885PPARA 1337/4885KLK7 3158/4885

“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.