SCHEMBL4092912

SCHEMBL4092912

CC(C)(C)OC(=O)NC(CCC(=O)c1ccc(F)c(F)c1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 11/20 0.49
PPARG P37231 10/20 0.49
PPARD Q03181 2/20 0.48
ACE P12821 1/20 0.47
ALDH1A1 P00352 2/20 0.43
MAPT P10636 2/20 0.43
PTPN1 P18031 1/20 0.43
TRPA1 O75762 1/20 0.43
CTSS P25774 3/20 0.42
CTSK P43235 3/20 0.42

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
SCHEMBL4514578 1.00 PPARA (0.49) PPARAPPARGPPARDACEALDH1A1
SCHEMBL4092905 1.00 PPARA (0.49) PPARAPPARGPPARDACEALDH1A1
SCHEMBL4510911 0.93 PPARA (0.45) PPARAPPARGPPARDACEALDH1A1
SCHEMBL4510905 0.93 PPARA (0.45) PPARAPPARGPPARDACEALDH1A1
SCHEMBL20835832 0.90 PPARA (0.52) PPARAPPARGPPARDACEALDH1A1
SCHEMBL20835831 0.90 PPARA (0.52) PPARAPPARGPPARDACEALDH1A1
SCHEMBL2575496 0.90 ALDH1A1 (0.45) PPARAPPARGPPARDACEALDH1A1
SCHEMBL4337302 0.88 ACE (0.46) PPARAPPARGPPARDACEALDH1A1
SCHEMBL4337305 0.88 ACE (0.46) PPARAPPARGPPARDACEALDH1A1
SCHEMBL2348575 0.88 MAPT (0.56) PPARAPPARGPPARDALDH1A1MAPT

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 6 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-20090203697-A1 HETEROCYCLIC TYPE CINNAMIDE DERIVATIVE EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-08-13 US disclosed
US-20090181945-A1 TWO CYCLIC CINNAMIDE COMPOUND KIMURA TEIJI 2009-07-16 US disclosed
EP-2019094-A1 HETEROCYCLIC TYPE CINNAMIDE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2009-01-28 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 (3 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 PPARA 1582/4885PPARG 2812/4885PPARD 2303/4885
US-20070117839-A1 Two cyclic cinnamide compound APP, BACE1, PSEN1 PPARA 1582/4885PPARG 2812/4885PPARD 2303/4885
US-20090203697-A1 HETEROCYCLIC TYPE CINNAMIDE DERIVATIVE CLIC4, NR3C2, MAN2B1 PPARA 1554/4885PPARG 2254/4885PPARD 1368/4885

“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.