SCHEMBL3945006

SCHEMBL3945006

CCOC(=O)C(CC)Cc1ccc(OC)c(C(C)=O)c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 19/20 0.52
PPARG P37231 9/20 0.52
PPARD Q03181 7/20 0.51
EPHX2 P34913 1/20 0.48
PSEN1 P49768 2/20 0.47
PSEN2 P49810 2/20 0.47
APH1B Q8WW43 2/20 0.47
NCSTN Q92542 2/20 0.47
APH1A Q96BI3 2/20 0.47
PSENEN Q9NZ42 2/20 0.47

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
SCHEMBL6380133 0.90 PPARA (0.55) PPARAPPARGPPARDEPHX2PSEN1
SCHEMBL3944543 0.86 PPARA (0.52) PPARAPPARGPPARDEPHX2PSEN1
SCHEMBL4328257 0.84 ALOX15 (0.57) PPARAPPARGPPARDEPHX2
SCHEMBL6503344 0.83 GAA (0.50) PPARAPPARGPPARDEPHX2
SCHEMBL6503458 0.82 PPARA (0.52) PPARAPPARGPPARDEPHX2
SCHEMBL3943600 0.81 PPARA (0.54) PPARAPPARGPPARDEPHX2
SCHEMBL3948497 0.81 PPARA (0.51) PPARAPPARGPPARDEPHX2
SCHEMBL3945079 0.81 EPHX2 (0.47) PPARAPPARGPPARDEPHX2
Hydrochloric Acid SCHEMBL3948175 0.80 PPARA (0.50) PPARAPPARGPPARDEPHX2
SCHEMBL14209735 0.78 PPARA (0.57) 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
EP-1285908-B9 SUBSTITUTED PHENYLPROPIONIC ACID DERIVATIVES KYORIN SEIYAKU KK (JP) 2009-04-22 EP disclosed
EP-1285908-B1 SUBSTITUTED PHENYLPROPIONIC ACID DERIVATIVES KYORIN SEIYAKU KK (JP) 2008-09-10 EP disclosed
US-7049342-B2 Substituted phenylpropionic acid derivatives KYORIN PHARMACEUTICAL CO., LTD. (JP) 2006-05-23 US disclosed
US-20030187068-A1 Substituted phenylpropionic acid derivatives KYORIN PHARMACEUTICAL CO., LTD. (JP) 2003-10-02 US disclosed
EP-1285908-A1 SUBSTITUTED PHENYLPROPIONIC ACID DERIVATIVES KYORIN PHARMACEUTICAL CO., LTD. (JP) 2003-02-26 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-20030187068-A1 Substituted phenylpropionic acid derivatives 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.