SCHEMBL6060712

SCHEMBL6060712

CCC(C(=O)O)N(Cc1ccc(OCCc2nc(-c3ccccc3)oc2C)cc1)C(=O)Oc1ccc(OC)cc1

nearest known ligand 0.73

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.73
PPARA Q07869 16/20 0.73
PPARD Q03181 2/20 0.56

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
SCHEMBL13721588 0.90 PPARG (0.74) PPARGPPARAPPARD
SCHEMBL13721584 0.90 PPARG (0.74) PPARGPPARAPPARD
SCHEMBL5430485 0.89 PPARG (0.58) PPARGPPARAPPARD
SCHEMBL5434396 0.89 PPARG (0.58) PPARGPPARAPPARD
SCHEMBL5434713 0.88 PPARG (0.59) PPARGPPARA
SCHEMBL14599062 0.86 PPARG (0.85) PPARGPPARA
SCHEMBL5434424 0.86 PPARG (0.55) PPARGPPARA
SCHEMBL13721589 0.84 PPARG (0.65) PPARGPPARAPPARD
Muraglitazar SCHEMBL676469 0.84 PPARA (1.00) PPARGPPARA
SCHEMBL5423680 0.83 PPARA (0.51) PPARGPPARAPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060177444-A1 Concomitant drug as therapeutic agent for inflammatory bowel disease EISAI R&D MANAGEMENT CO., LTD. (JP) 2006-08-10 US disclosed
EP-1607103-A1 CONCOMITANT DRUG AS THERAPEUTIC AGENT FOR INFLAMMATORY BOWEL DISEASE Eisai Co., Ltd. (JP) 2005-12-21 EP 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-20060177444-A1 Concomitant drug as therapeutic agent for inflammatory bowel disease PPARG, PPARA, NR3C1 PPARG 1/4885PPARA 2/4885PPARD 4/4885

“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.