SCHEMBL1708583

SCHEMBL1708583

COc1ccc(-c2cccc(CNc3ccc4c(c3)OC[C@H]4CC(=O)O)c2C)cn1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 15/20 0.49
PPARD Q03181 10/20 0.44
PPARG P37231 8/20 0.44
PPARA Q07869 2/20 0.44
PDCD1 Q15116 1/20 0.42
CD274 Q9NZQ7 1/20 0.42

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
SCHEMBL13048415 0.93 FFAR1 (0.42) FFAR1PPARDPPARGPPARAPDCD1
SCHEMBL10291540 0.90 CD274 (0.41) FFAR1PPARDPDCD1CD274
SCHEMBL1708466 0.89 FFAR1 (0.49) FFAR1PPARDPPARGPPARA
SCHEMBL10291548 0.88 FFAR1 (0.51) FFAR1PPARDPPARGPPARAPDCD1
SCHEMBL3715116 0.85 FFAR1 (0.45) FFAR1PPARDPPARGPPARA
SCHEMBL1708584 0.85 CD274 (0.41) PDCD1CD274
SCHEMBL10010387 0.80 FFAR1 (0.46) FFAR1PPARDPPARGPPARA
SCHEMBL10009860 0.79 FFAR1 (0.54) FFAR1PPARDPPARG
SCHEMBL10011340 0.79 FFAR1 (0.51) FFAR1PPARDPPARGPPARA
SCHEMBL3721709 0.77 FFAR1 (0.46) FFAR1PPARDPPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120172351-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-07-05 US disclosed
EP-2440541-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2012-04-18 EP disclosed
WO-2010143733-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-12-16 WO disclosed
WO-2010143733-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-12-16 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-20120172351-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF GPR119, INSR, GLP1R FFAR1 20/4885PPARD 133/4885PPARG 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.