SCHEMBL5403582

SCHEMBL5403582

Cc1oc(-c2ccccc2)nc1COc1ccc(Cc2nc(CCC(=O)O)c(-c3ccccc3)s2)cc1

nearest known ligand 0.72

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.72
PPARG P37231 18/20 0.59
PPARA Q07869 15/20 0.59
KDR P35968 1/20 0.51
PPARD Q03181 2/20 0.49

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
SCHEMBL5407283 0.92 FFAR1 (0.61) FFAR1PPARGPPARAKDR
SCHEMBL1745059 0.83 FFAR1 (0.96) FFAR1PPARGPPARAPPARD
SCHEMBL5395522 0.83 FFAR1 (0.76) FFAR1PPARGPPARAKDRPPARD
SCHEMBL5411060 0.81 FFAR1 (0.84) FFAR1PPARGPPARAKDRPPARD
SCHEMBL4034751 0.80 FFAR1 (0.81) FFAR1PPARGPPARAKDRPPARD
SCHEMBL5415046 0.79 FFAR1 (0.74) FFAR1PPARGPPARAPPARD
SCHEMBL5403127 0.79 FFAR1 (0.72) FFAR1PPARGPPARAKDRPPARD
SCHEMBL5403576 0.78 FFAR1 (0.79) FFAR1PPARGPPARAKDRPPARD
SCHEMBL12652902 0.78 FFAR1 (0.78) FFAR1PPARGPPARAKDR
SCHEMBL4033748 0.78 FFAR1 (0.78) FFAR1PPARGPPARAKDRPPARD

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-7241785-B2 Five-membered heterocyclic alkanoic acid derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-07-10 US disclosed
US-20040063775-A1 Five-membered heterocyclic alkanoic acid derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-01 US disclosed
EP-1394154-A1 FIVE-MEMBERED HETEROCYCLIC ALKANOIC ACID DERIVATIVE Takeda Chemical Industries, Ltd. (JP) 2004-03-03 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-20040063775-A1 Five-membered heterocyclic alkanoic acid derivative SLC5A1, AHR, ALOX5 FFAR1 14/4885PPARG 433/4885PPARA 301/4885

“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.