SCHEMBL4846010

SCHEMBL4846010

COc1cc(COc2nn(C)cc2C(=O)O)ccc1OCc1nc(-c2ccccc2)oc1C

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.48
MAPT P10636 4/20 0.46
PPARG P37231 11/20 0.46
PPARA Q07869 10/20 0.46
KDR P35968 1/20 0.45
SMN1; SMN2 Q16637 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
SCHEMBL4848956 0.95 FFAR1 (0.47) FFAR1MAPTPPARGPPARAKDR
SCHEMBL4851961 0.94 FFAR1 (0.46) FFAR1MAPTPPARGPPARAKDR
SCHEMBL4847914 0.93 FFAR1 (0.45) FFAR1MAPTPPARGPPARAKDR
SCHEMBL4850776 0.92 PPARG (0.44) FFAR1MAPTPPARGPPARAKDR
SCHEMBL4846783 0.91 PPARG (0.55) FFAR1MAPTPPARGPPARAKDR
SCHEMBL5393169 0.90 FFAR1 (0.47) FFAR1MAPTPPARGPPARAKDR
SCHEMBL4847025 0.90 FFAR1 (0.45) FFAR1MAPTPPARGPPARAKDR
SCHEMBL4845504 0.89 KDR (0.48) FFAR1MAPTPPARGPPARAKDR
SCHEMBL4852754 0.88 FFAR1 (0.42) FFAR1MAPTPPARGPPARAKDR
SCHEMBL4848715 0.88 KDR (0.44) FFAR1MAPTPPARGPPARAKDR

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-7368578-B2 Five-membered heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-05-06 US disclosed
US-20060135578-A1 Five-membered heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-06-22 US disclosed
EP-1541564-A1 FIVE-MEMBERED HETEROCYCLIC COMPOUNDS Takeda Pharmaceutical Company Limited (JP) 2005-06-15 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-20060135578-A1 Five-membered heterocyclic compounds GPR119, OR10J3, CYP11B1 FFAR1 771/4885MAPT 4700/4885PPARG 536/4885

“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.