SCHEMBL2528903

SCHEMBL2528903

Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1CC(Oc1cccc2ncsc12)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 18/20 0.51
PPARA Q07869 14/20 0.51
PPARG P37231 8/20 0.47
FFAR1 O14842 4/20 0.47

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
SCHEMBL4447867 0.77 PPARD (0.46) PPARDPPARAPPARGFFAR1
SCHEMBL6532563 0.73 PPARD (0.52) PPARDPPARAPPARGFFAR1
SCHEMBL2528901 0.72 PPARD (0.60) PPARDPPARAPPARGFFAR1
SCHEMBL4441887 0.71 PPARA (0.44) PPARDPPARAPPARGFFAR1
SCHEMBL5697537 0.71 PPARD (0.71) PPARDPPARAPPARGFFAR1
SCHEMBL2465068 0.71 PPARD (0.71) PPARDPPARAPPARGFFAR1
SCHEMBL4447868 0.71 PPARD (0.44) PPARDPPARA
SCHEMBL2521255 0.70 PPARA (0.59) PPARDPPARAPPARGFFAR1
SCHEMBL5697527 0.70 PPARD (0.74) PPARDPPARAPPARGFFAR1
SCHEMBL5697544 0.69 PPARD (0.73) PPARDPPARAPPARGFFAR1

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-20100048658-A1 FUSED HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED 2010-02-25 US claimed
US-8039500-B2 Fused heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-10-18 US disclosed
US-20100048658-A1 FUSED HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED 2010-02-25 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-20100048658-A1 FUSED HETEROCYCLIC COMPOUNDS CRHR1, CRHR2, CRH PPARD 1892/4885PPARA 2523/4885PPARG 2525/4885

“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.