SCHEMBL5772496

SCHEMBL5772496

COc1ccc(-c2ccc3c(c2)c(-c2ccc(F)c(C)c2)c(C(=O)O)n3Cc2cccc(C(F)(F)F)c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.57
EDNRB P24530 4/20 0.49
EDNRA P25101 2/20 0.49
F2RL3 Q96RI0 1/20 0.47
ICMT O60725 2/20 0.46
PLA2G2A P14555 1/20 0.46
SERPINE1 P05121 1/20 0.44
TP53 P04637 1/20 0.43
POLB P06746 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2B Q13224 1/20 0.43
PTGES O14684 1/20 0.43

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
SCHEMBL6091159 0.93 PPARG (0.65) PPARGEDNRBEDNRAF2RL3ICMT
SCHEMBL6093344 0.91 PPARG (0.65) PPARGEDNRBEDNRAF2RL3ICMT
SCHEMBL6093520 0.91 PPARG (0.58) PPARGEDNRBEDNRAF2RL3ICMT
SCHEMBL6092255 0.91 ICMT (0.48) PPARGICMTSERPINE1GRIN1GRIN2B
SCHEMBL6090091 0.87 PPARG (0.57) PPARGEDNRBEDNRAF2RL3ICMT
SCHEMBL6093343 0.86 PPARG (0.55) PPARGEDNRBEDNRAF2RL3ICMT
SCHEMBL6092537 0.86 PPARG (0.59) PPARGEDNRBEDNRAF2RL3SERPINE1
SCHEMBL5745661 0.85 PPARG (0.54) PPARGEDNRBEDNRAF2RL3ICMT
SCHEMBL6858382 0.85 PPARG (0.76) PPARGEDNRBEDNRAF2RL3SERPINE1
SCHEMBL6091680 0.84 PPARG (0.61) PPARGEDNRBEDNRAF2RL3ICMT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060160879-A1 Indoles useful in the treatment of inflammation BIOLIPOX AB (SE) 2006-07-20 US disclosed
EP-1646624-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2006-04-19 EP disclosed
WO-2005005415-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2005-01-20 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-20060160879-A1 Indoles useful in the treatment of inflammation IDO1, PTGS1, IDO2 PPARG 481/4885EDNRB 226/4885EDNRA 155/4885

“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.