SCHEMBL2585113

SCHEMBL2585113

CC(C)(C)OC(=O)N[C@](C)(CCCC(=O)c1ccc(Cl)cc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
MAPT P10636 2/20 0.45
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
MAPK1 P28482 1/20 0.44
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
TSHR P16473 2/20 0.40
PKM P14618 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.39
POLB P06746 1/20 0.39
DRD2 P14416 5/20 0.39
ERCC5 P28715 1/20 0.38
FEN1 P39748 1/20 0.38
MMP1 P03956 1/20 0.38
HPGD P15428 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL2581131 0.85 DRD2 (0.37) ALDH1A1MAPTMEN1KMT2APPARG
SCHEMBL23878364 0.80 LMNA (0.46) ALDH1A1MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL4330484 0.80 AAK1 (0.34)
SCHEMBL2575528 0.80 ALDH1A1 (0.47) ALDH1A1MAPTMEN1KMT2AMAPK1
SCHEMBL4510182 0.77 PPARG (0.58) ALDH1A1MAPTPPARGPPARATSHR
SCHEMBL4510174 0.77 PPARG (0.58) ALDH1A1MAPTPPARGPPARATSHR
SCHEMBL2575501 0.77 CHRNA1 (0.38) ALDH1A1MAPTMEN1KMT2APPARG
SCHEMBL2836400 0.77 GAA (0.50) ALDH1A1MAPTPPARGPPARALMNA
SCHEMBL4502068 0.74 PPARA (0.64) ALDH1A1MAPTPPARGPPARATSHR
SCHEMBL4502065 0.74 PPARA (0.64) ALDH1A1MAPTPPARGPPARATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8048878-B2 Two cyclic cinnamide compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-11-01 US disclosed
US-7618960-B2 Morpholine type cinnamide compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-11-17 US disclosed
US-20070117798-A1 Morpholine type 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 (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-20070117798-A1 Morpholine type cinnamide compound MLX, XDH, NOX4 ALDH1A1 785/4885MAPT 3321/4885MEN1 235/4885

“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.