SCHEMBL4521952

SCHEMBL4521952

CC(C)(C)OC(=O)NC(CCC(=O)c1ccc(F)cc1F)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 11/20 0.47
PPARG P37231 10/20 0.47
ACE P12821 1/20 0.46
CTSS P25774 3/20 0.45
CTSK P43235 3/20 0.45
PPARD Q03181 2/20 0.45
PTPN1 P18031 1/20 0.43
ACKR3 P25106 1/20 0.41
FOLH1 Q04609 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
ALOX12 P18054 1/20 0.40

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
SCHEMBL4521942 1.00 PPARA (0.47) PPARAPPARGACECTSSCTSK
SCHEMBL4510452 0.91 PPARA (0.47) PPARAPPARGACECTSSCTSK
SCHEMBL4510448 0.91 PPARA (0.47) PPARAPPARGACECTSSCTSK
SCHEMBL2578532 0.88 ALDH1A1 (0.52) PPARAPPARGCTSSCTSKACKR3
SCHEMBL4504469 0.87 PPARA (0.46) PPARAPPARGACECTSSCTSK
SCHEMBL4504464 0.87 PPARA (0.46) PPARAPPARGACECTSSCTSK
SCHEMBL31149113 0.86 ACKR3 (0.43) PPARGCTSSCTSKACKR3ALDH1A1
SCHEMBL22039761 0.86 ACKR3 (0.43) PPARGCTSSCTSKACKR3ALDH1A1
SCHEMBL4511753 0.85 PPARA (0.47) PPARAPPARGACECTSSCTSK
SCHEMBL4511750 0.85 PPARA (0.47) PPARAPPARGACECTSSCTSK

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 4 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-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 PPARA 1582/4885PPARG 2812/4885ACE 738/4885
US-20070117839-A1 Two cyclic cinnamide compound APP, BACE1, PSEN1 PPARA 1582/4885PPARG 2812/4885ACE 738/4885

“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.