SCHEMBL4510182

SCHEMBL4510182

CC(C)(C)OC(=O)NC(CCCC(=O)c1ccc(Cl)cc1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.58
PPARA Q07869 7/20 0.58
ALDH1A1 P00352 2/20 0.54
MAPT P10636 1/20 0.54
PPARD Q03181 2/20 0.47
TSHR P16473 2/20 0.46
JAK3 P52333 1/20 0.46
BTK Q06187 1/20 0.46
LMNA P02545 1/20 0.46
GRN P28799 1/20 0.45
SORT1 Q99523 1/20 0.45
ACE P12821 1/20 0.45
P2RY2 P41231 1/20 0.44
CTSK P43235 4/20 0.44
CTSS P25774 1/20 0.44

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
SCHEMBL4510174 1.00 PPARG (0.58) PPARGPPARAALDH1A1MAPTPPARD
SCHEMBL4502068 0.93 PPARA (0.64) PPARGPPARAALDH1A1MAPTPPARD
SCHEMBL4502065 0.93 PPARA (0.64) PPARGPPARAALDH1A1MAPTPPARD
SCHEMBL3626360 0.89 ALDH1A1 (0.56) PPARGPPARAALDH1A1MAPTTSHR
SCHEMBL2585108 0.89 ALDH1A1 (0.56) PPARGPPARAALDH1A1MAPTTSHR
SCHEMBL4092761 0.88 CTSS (0.49) PPARGPPARAALDH1A1PPARDTSHR
SCHEMBL4092754 0.88 CTSS (0.49) PPARGPPARAALDH1A1PPARDTSHR
SCHEMBL4510911 0.85 PPARA (0.45) PPARGPPARAALDH1A1PPARDTSHR
SCHEMBL4510905 0.85 PPARA (0.45) PPARGPPARAALDH1A1PPARDTSHR
SCHEMBL3719212 0.83 PPARA (0.60) PPARGPPARAALDH1A1MAPTPPARD

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-1953158-B1 BICYCLIC CINNAMIDE COMPOUND EISAI R&D MAN CO LTD (JP) 2012-09-12 EP disclosed
US-20090181945-A1 TWO CYCLIC CINNAMIDE COMPOUND KIMURA TEIJI 2009-07-16 US disclosed
EP-1953154-A1 MORPHOLINE TYPE CINNAMIDE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2008-08-06 EP disclosed
EP-1953158-A1 BICYCLIC CINNAMIDE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2008-08-06 EP disclosed
US-20070117839-A1 Two cyclic cinnamide compound EISAI R&D MANAGEMENT CO., LTD. 2007-05-24 US 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 (2 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-20090181945-A1 TWO CYCLIC CINNAMIDE COMPOUND APP, BACE1, PSEN1 PPARG 2812/4885PPARA 1582/4885ALDH1A1 869/4885
US-20070117839-A1 Two cyclic cinnamide compound APP, BACE1, PSEN1 PPARG 2812/4885PPARA 1582/4885ALDH1A1 869/4885

“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.