SCHEMBL4097221

SCHEMBL4097221

CC(C)Oc1ccc(-n2c(C(=O)O)cc3c(-c4ccc(C(F)(F)F)cc4)nc(-c4ccc(C(F)(F)F)cc4)cc32)cc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGES O14684 3/20 0.55
MCL1 Q07820 6/20 0.43
BTK Q06187 1/20 0.43
PPARD Q03181 1/20 0.40
CASR P41180 1/20 0.39
TEAD1 P28347 1/20 0.38
TEAD4 Q15561 1/20 0.38
TEAD2 Q15562 1/20 0.38
TEAD3 Q99594 1/20 0.38
BCL2 P10415 3/20 0.37
MDM2 Q00987 3/20 0.37
PTPN5 P54829 1/20 0.36
FPR2 P25090 1/20 0.36
SCN9A Q15858 1/20 0.36
PPARG P37231 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
SCHEMBL4095101 0.90 PTGES (0.55) PTGESMCL1PPARDCASRTEAD1
SCHEMBL4096031 0.89 PTGES (0.43) PTGESMCL1BTKPPARDCASR
SCHEMBL4268491 0.83 PTGES (0.60) PTGESMCL1PPARDTEAD1TEAD4
SCHEMBL4090259 0.82 PTGES (0.61) PTGESMCL1PPARDBCL2MDM2
SCHEMBL4089150 0.82 PTGES (0.46) PTGESMCL1BTKCASRBCL2
SCHEMBL3570895 0.81 PTGES (0.83) PTGESMCL1PPARDTEAD1TEAD4
SCHEMBL4101335 0.79 PTGES (0.43) PTGESPPARDCASR
SCHEMBL4096749 0.78 PTGES (0.47) PTGESTEAD1TEAD4TEAD2TEAD3
SCHEMBL3582187 0.77 PTGES (0.67) PTGESMCL1PPARDTEAD1TEAD4
SCHEMBL4101074 0.77 PTGES (0.54) PTGESMCL1TEAD1TEAD4TEAD2

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 PTGES 47/4885MCL1 1709/4885BTK 2792/4885

“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.