SCHEMBL4097658

SCHEMBL4097658

COc1ccc(C(=O)c2ccc(OCCc3ccc(C#N)cc3)cc2)c(OC(C)(C)C(=O)O)c1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 14/20 0.59
PPARD Q03181 11/20 0.59
PPARG P37231 10/20 0.56
NPC1 O15118 1/20 0.45
VNN1 O95497 1/20 0.43

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
SCHEMBL4107844 0.90 PPARG (0.54) PPARAPPARDPPARGNPC1VNN1
SCHEMBL4097793 0.89 PPARG (0.64) PPARAPPARDPPARGNPC1
SCHEMBL4099824 0.87 PPARG (0.61) PPARAPPARDPPARG
SCHEMBL4099680 0.87 PPARG (0.55) PPARAPPARDPPARGNPC1
SCHEMBL4092953 0.85 PPARG (0.59) PPARAPPARDPPARGNPC1
SCHEMBL4107824 0.84 NPC1 (0.58) PPARAPPARDPPARGNPC1
SCHEMBL4091511 0.83 PPARG (0.51) PPARAPPARDPPARGNPC1
SCHEMBL4097609 0.82 NPC1 (0.52) PPARAPPARDPPARGNPC1
SCHEMBL4107394 0.79 PPARG (0.63) PPARAPPARDPPARGNPC1
SCHEMBL4106819 0.79 PPARG (0.47) PPARAPPARDPPARGNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090054435-A1 Phenoxyalkanoic Acid Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-02-26 US disclosed
EP-1911738-A1 PHENOXYALKANOIC ACID COMPOUND Takeda Pharmaceutical Company Limited (JP) 2008-04-16 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-20090054435-A1 Phenoxyalkanoic Acid Compound PNLIP, GPR119, LIPC PPARA 8/4885PPARD 30/4885PPARG 23/4885

“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.