SCHEMBL4097135

SCHEMBL4097135

COc1ccc(C(=O)c2ccc(OCc3nc(-c4cccc(OS(C)(=O)=O)c4)oc3C)cc2)c(OC(C)(C)C(=O)O)c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.49
PPARG P37231 7/20 0.48
PPARA Q07869 7/20 0.48
TP53 P04637 2/20 0.48
PPARD Q03181 2/20 0.47
ESR1 P03372 1/20 0.44
THRA P10827 1/20 0.44
THRB P10828 1/20 0.44
VDR P11473 1/20 0.44
RXRA P19793 1/20 0.44
ESR2 Q92731 1/20 0.44
KDM4E B2RXH2 2/20 0.44
POLB P06746 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 1/20 0.44
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
TSHR P16473 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
SCHEMBL4103807 0.89 PPARA (0.58) MAPTPPARGPPARATP53PPARD
SCHEMBL4099013 0.83 MAPT (0.47) MAPTPPARGPPARATP53POLB
SCHEMBL4107292 0.82 PPARA (0.69) PPARGPPARAPPARD
SCHEMBL4755678 0.81 MAPT (0.57) MAPTPPARGPPARATP53PPARD
SCHEMBL4092427 0.80 MAPT (0.61) MAPTPPARGPPARATP53POLB
SCHEMBL4109852 0.78 MAPT (0.61) MAPTPPARGPPARATP53PPARD
SCHEMBL4102445 0.77 PPARA (0.49) MAPTPPARGPPARAPPARDKDM4E
SCHEMBL4100506 0.77 FFAR1 (0.60) MAPTPPARGPPARATP53POLB
SCHEMBL4111348 0.76 MAPT (0.56) MAPTPPARGPPARATP53VDR
SCHEMBL4098230 0.76 MAPT (0.62) MAPTPPARGPPARATP53POLB

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 MAPT 3533/4885PPARG 23/4885PPARA 8/4885

“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.