SCHEMBL5126597

SCHEMBL5126597

CC[C@@H](Cc1ccc(OC)c(C(=O)NCc2ccc(Oc3cc(F)cc(Cl)c3)cc2)c1)C(=O)O

nearest known ligand 0.82

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 20/20 0.82
PPARG P37231 12/20 0.82
PPARD Q03181 8/20 0.82
PSEN1 P49768 2/20 0.65
PSEN2 P49810 2/20 0.65
APH1B Q8WW43 2/20 0.65
NCSTN Q92542 2/20 0.65
APH1A Q96BI3 2/20 0.65
PSENEN Q9NZ42 2/20 0.65

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
SCHEMBL5111743 0.94 PPARA (0.89) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL5120237 0.94 PPARA (0.82) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL5125251 0.92 PPARA (0.79) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL5147335 0.90 PPARA (1.00) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL29557298 0.90 PPARA (1.00) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL2742676 0.90 PPARA (1.00) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL5125451 0.90 PPARA (0.75) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL5111622 0.90 PPARA (0.82) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL5125922 0.89 PPARA (0.75) PPARAPPARGPPARDPSEN1PSEN2
SCHEMBL5119455 0.88 PPARA (0.79) PPARAPPARGPPARDPSEN1PSEN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7361783-B2 (2S)-2-ethylphenylpropionic acid derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2008-04-22 US claimed
US-7361783-B2 (2S)-2-ethylphenylpropionic acid derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2008-04-22 US disclosed
EP-1508566-B1 (2S)-2-ETHYLPHENYLPROPIONIC ACID DERIVATIVE KYORIN SEIYAKU KK (JP) 2007-07-18 EP disclosed
US-20060084702-A1 (2S)-2-ethylphenylpropionic acid derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2006-04-20 US disclosed
EP-1508566-A1 (2S)-2-ETHYLPHENYLPROPIONIC ACID DERIVATIVE KYORIN PHARMACEUTICAL CO., LTD. (JP) 2005-02-23 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-20060084702-A1 (2S)-2-ethylphenylpropionic acid derivative PPARA, PPARG, PPARD PPARA 1/4885PPARG 2/4885PPARD 3/4885

“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.