SCHEMBL1708223

SCHEMBL1708223

Cc1c(CNc2ccc3c(c2)OC[C@H]3CC(=O)O)ccc(C(F)(F)F)c1-c1cnc(N2CCOCC2)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 18/20 0.42
GAA P10253 1/20 0.38
PPARD Q03181 4/20 0.36
PPARG P37231 2/20 0.36
STAT6 P42226 1/20 0.34

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
SCHEMBL1708456 0.92 FFAR1 (0.45) FFAR1STAT6
SCHEMBL10010676 0.89 FFAR1 (0.43) FFAR1GAAPPARDPPARG
SCHEMBL1708224 0.87 GAA (0.36) GAASTAT6
SCHEMBL10009384 0.85 FFAR1 (0.45) FFAR1PPARDPPARG
SCHEMBL1707868 0.85 FFAR1 (0.38) FFAR1GAASTAT6
SCHEMBL13046563 0.85 FFAR1 (0.40) FFAR1GAASTAT6
SCHEMBL10009829 0.84 FFAR1 (0.35) FFAR1PPARDPPARG
SCHEMBL10292319 0.83 FFAR1 (0.36) FFAR1GAASTAT6
SCHEMBL3715116 0.81 FFAR1 (0.45) FFAR1PPARDPPARG
SCHEMBL10010507 0.80 FFAR1 (0.47) FFAR1PPARD

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
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

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 20/4885GAA 3185/4885PPARD 133/4885

“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.