SCHEMBL2528243

SCHEMBL2528243

Cc1ccc(CC(=O)Oc2ccc(C(O)CNCC(=O)OC(C)(C)C)cc2)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.35
CCR2 P41597 3/20 0.34
ADRB3 P13945 3/20 0.34
LMNA P02545 1/20 0.33
CYP3A4 P08684 1/20 0.33
HIF1A Q16665 1/20 0.33
HTT P42858 1/20 0.33
PSMB5 P28074 2/20 0.32
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
PSMB8 P28062 1/20 0.32
ADRB2 P07550 1/20 0.32

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
SCHEMBL2529782 0.92 L3MBTL1 (0.35) L3MBTL1ALDH1A1MAPTADRB3LMNA
SCHEMBL2529928 0.89 L3MBTL1 (0.36) L3MBTL1ALDH1A1MAPTADRB3LMNA
SCHEMBL2528949 0.86 L3MBTL1 (0.42) L3MBTL1ALDH1A1MAPTADRB3PPARG
SCHEMBL2527801 0.84 MEN1 (0.42)
SCHEMBL2529688 0.84 ALDH1A1 (0.43) L3MBTL1ALDH1A1MAPTADRB3HTT
SCHEMBL2531906 0.84 ADRB3 (0.38) L3MBTL1MAPTADRB3PPARGPPARA
SCHEMBL2526478 0.84 PPARG (0.38) L3MBTL1ADRB3PPARGPPARA
SCHEMBL2532004 0.82 HSD17B10 (0.44) L3MBTL1ADRB3LMNAADRB2
SCHEMBL2531030 0.82 ADRB3 (0.38) L3MBTL1ADRB3
SCHEMBL2532055 0.82 CA2 (0.40) L3MBTL1ALDH1A1ADRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8039501-B2 Synephrine derivatives useful as anti-inflammatory agents UNIVERSITEIT GENT (BE) 2011-10-18 US disclosed
US-20090029999-A1 Synephrine derivatives useful as anti-inflammatory agents UNIVERSITEIT GENT (BE) 2009-01-29 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-20090029999-A1 Synephrine derivatives useful as anti-inflammatory agents HRH1, HRH3, HRH2 L3MBTL1 4486/4885ALDH1A1 3248/4885MAPT 2834/4885

“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.