SCHEMBL1708398

SCHEMBL1708398

Cc1nc2ccccc2n1-c1cccc2c1OC[C@@H]2Nc1ccc2c(c1)OC[C@H]2CC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.40
PPARD Q03181 10/20 0.40
FFAR1 O14842 15/20 0.39
PPARA Q07869 2/20 0.39
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL1708110 1.00 PPARG (0.40) PPARGPPARDFFAR1PPARATSHR
SCHEMBL1707943 1.00 PPARG (0.40) PPARGPPARDFFAR1PPARATSHR
SCHEMBL1708595 0.92 TSHR (0.39) PPARGPPARDFFAR1PPARATSHR
SCHEMBL1708167 0.92 PPARG (0.39) PPARGPPARDFFAR1PPARA
SCHEMBL1708165 0.92 FFAR1 (0.42) PPARGPPARDFFAR1PPARA
SCHEMBL1707941 0.92 PPARG (0.39) PPARGPPARDFFAR1PPARA
SCHEMBL1708394 0.91 FFAR1 (0.40) PPARGPPARDFFAR1PPARA
SCHEMBL1708626 0.91 FFAR1 (0.40) PPARGPPARDFFAR1PPARA
SCHEMBL1708286 0.91 FFAR1 (0.40) PPARGPPARDFFAR1PPARA
SCHEMBL1708001 0.88 FFAR1 (0.41) PPARGPPARDFFAR1PPARA

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 PPARG 155/4885PPARD 133/4885FFAR1 20/4885

“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.