SCHEMBL4090165

SCHEMBL4090165

CC(C)Oc1ccc(-n2c(C(=O)O)c(Cl)c3nc(Oc4cccc(Cl)c4)ccc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.42
EGLN1 Q9GZT9 1/20 0.39
PTGES O14684 2/20 0.38
MCL1 Q07820 2/20 0.38
BCL2 P10415 1/20 0.38
MDM2 Q00987 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
MAP4K4 O95819 1/20 0.37
PPARA Q07869 1/20 0.36
USP2 O75604 2/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2D6 P10635 2/20 0.35
TSHR P16473 2/20 0.35
CYP2C19 P33261 2/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL4101567 0.85 MDM2 (0.43) PPARGEGLN1MCL1BCL2MDM2
SCHEMBL4095158 0.84 ADRB3 (0.38) PPARGEGLN1HRH3MAP4K4ALDH1A1
SCHEMBL4095879 0.83 PPARG (0.43) PPARGMCL1BCL2MDM2HRH3
SCHEMBL4094387 0.82 PTGES (0.47) PPARGPTGESMCL1BCL2MDM2
SCHEMBL333839 0.79 PPARG (0.47) PPARGPTGESMCL1BCL2MDM2
SCHEMBL4224601 0.77 PTGES (0.58) PPARGPTGESMCL1BCL2MDM2
SCHEMBL4095050 0.76 PTGES (0.48) PPARGPTGESMCL1BCL2MDM2
SCHEMBL333958 0.74 KDM4E (0.42) PPARGPTGESPPARACYP1A2CYP3A4
SCHEMBL4924264 0.74 PTGES (0.52) PPARGPTGES
SCHEMBL3009858 0.72 PTGES (0.42) PPARGPTGESMCL1BCL2MDM2

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-20090048285-A1 Pyrrolopyridines Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2009-02-19 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-20090048285-A1 Pyrrolopyridines Useful in the Treatment of Inflammation PYCR1, ARG2, ARG1 PPARG 1316/4885EGLN1 3623/4885PTGES 47/4885

“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.