SCHEMBL5472102

SCHEMBL5472102

C=CCc1cc(C[N+](C)(Cc2nc(-c3cccc(Br)c3)oc2C)C(=O)NC)ccc1OC(C)(C)C(=O)[O-]

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 12/20 0.46
PPARG P37231 10/20 0.46
TP53 P04637 1/20 0.37
POLB P06746 2/20 0.36
RXFP1 Q9HBX9 1/20 0.36
LMNA P02545 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL5475649 0.92 PPARA (0.41) PPARAPPARG
Trifluoroacetic Acid SCHEMBL5484473 0.91 PPARA (0.51) PPARAPPARGPOLBRXFP1
Trifluoroacetic Acid SCHEMBL5487771 0.84 PPARA (0.46) PPARAPPARG
SCHEMBL5476323 0.78 PPARA (0.71) PPARAPPARGPOLBRXFP1MEN1
SCHEMBL5472100 0.77 PPARA (0.60) PPARAPPARG
SCHEMBL14414906 0.77 PPARA (0.60) PPARAPPARGTP53POLBRXFP1
SCHEMBL14414955 0.75 PPARG (0.51) PPARAPPARG
Trifluoroacetic Acid SCHEMBL5484472 0.75 PPARA (0.58) PPARAPPARG
SCHEMBL5484478 0.74 PPARG (0.49) PPARAPPARGPOLBMEN1KMT2A
SCHEMBL5480361 0.73 PPARA (0.46) PPARAPPARGLMNAKMT2A

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-20070208021-A1 Phenoxyacetic Acid Derivatives and Drug Comprising The Same DAIICHI PHARMACEUTICAL CO., LTD. 2007-09-06 US disclosed
EP-1731513-A1 PHENOXYACETIC ACID DERIVATIVE AND MEDICINE CONTAINING THE SAME DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-12-13 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-20070208021-A1 Phenoxyacetic Acid Derivatives and Drug Comprising The Same PPARA, PPARG, PPARD PPARA 1/4885PPARG 2/4885TP53 1596/4885

“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.