SCHEMBL4098417

SCHEMBL4098417

COCOc1ccc(C(=O)c2ccc(OCc3nc(-c4ccccc4)oc3C)cc2)c(OCCOC(C)=O)c1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.51
MAPT P10636 4/20 0.49
PPARG P37231 10/20 0.48
PPARA Q07869 8/20 0.48
PTPN2 P17706 1/20 0.48
PTPN1 P18031 1/20 0.48
TP53 P04637 1/20 0.47
POLB P06746 1/20 0.47
KDR P35968 1/20 0.47
PPARD Q03181 1/20 0.46

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
SCHEMBL4096576 0.88 PPARG (0.57) FFAR1MAPTPPARGPPARATP53
SCHEMBL4107823 0.88 FFAR1 (0.55) FFAR1MAPTPPARGPPARAPTPN2
SCHEMBL4092427 0.87 MAPT (0.61) FFAR1MAPTPPARGPPARATP53
SCHEMBL4103742 0.87 MAPT (0.53) FFAR1MAPTPPARGPPARAPTPN2
SCHEMBL4098414 0.87 PPARG (0.52) FFAR1MAPTPPARGPPARATP53
SCHEMBL4097664 0.86 FFAR1 (0.56) FFAR1MAPTPPARGPPARATP53
SCHEMBL4098324 0.84 FFAR1 (0.57) FFAR1MAPTPPARGPPARATP53
SCHEMBL4100506 0.82 FFAR1 (0.60) FFAR1MAPTPPARGPPARATP53
SCHEMBL4111348 0.82 MAPT (0.56) FFAR1MAPTPPARGPPARATP53
SCHEMBL4106249 0.81 MAPT (0.62) FFAR1MAPTPPARGPPARATP53

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 FFAR1 20/4885MAPT 3533/4885PPARG 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.