SCHEMBL3013327

SCHEMBL3013327

CSc1c(C(=O)O)n(-c2ccc(OC(C)C)cc2)c2ccc(-c3ccc(C(F)(F)F)cn3)cc12

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGES O14684 3/20 0.43
PPARG P37231 15/20 0.41
PPARA Q07869 6/20 0.41
ALOX5AP P20292 1/20 0.38
PTPN11 Q06124 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
SCHEMBL2997313 0.93 ALOX5AP (0.45) PTGESPPARGPPARAALOX5AP
SCHEMBL3010510 0.90 PTGES (0.38) PTGESPPARGPPARAALOX5AP
Hydrochloric Acid SCHEMBL3010507 0.89 PTGES (0.38) PTGESPPARGPPARAALOX5AP
SCHEMBL334396 0.89 PTGES (0.45) PTGESPPARGPPARAPTPN11
SCHEMBL3001794 0.89 PTGES (0.45) PTGESPPARGPPARAPTPN11
SCHEMBL3011271 0.89 PTGES (0.45) PTGESPPARGPPARAPTPN11
SCHEMBL3572273 0.88 PTGES (0.45) PTGESPPARGPPARA
SCHEMBL3006446 0.87 PTGES (0.44) PTGESPPARGPPARA
SCHEMBL3013088 0.87 PTGES (0.45) PTGESPPARGPPARAPTPN11
SCHEMBL334351 0.86 PTGES (0.45) PTGESPPARGPPARAALOX5AP

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-20100197687-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2010-08-05 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-20100197687-A1 Indoles Useful in the Treatment of Inflammation IDO1, IDO2, TPH1 PTGES 33/4885PPARG 2505/4885PPARA 3519/4885

“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.