SCHEMBL2528951

SCHEMBL2528951

Cc1ccc(CC(=O)Oc2ccc(C(O)CN(C)C(=O)OC(C)(C)C)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.42
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
UTS2R Q9UKP6 2/20 0.38
KMT2A Q03164 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
ATM Q13315 1/20 0.36
AOC3 Q16853 1/20 0.34
KEAP1 Q14145 1/20 0.34
NFE2L2 Q16236 1/20 0.34
ELANE P08246 1/20 0.34

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
SCHEMBL2527548 0.91 KMT2A (0.46) L3MBTL1PPARGPPARAUTS2RKMT2A
SCHEMBL2527448 0.91 KMT2A (0.41) L3MBTL1PPARGPPARAKMT2ATDP1
SCHEMBL2526376 0.90 KMT2A (0.46) L3MBTL1PPARGPPARAKMT2ATDP1
SCHEMBL2526417 0.90 KMT2A (0.46) L3MBTL1PPARGPPARAUTS2RKMT2A
SCHEMBL2529210 0.90 KMT2A (0.40) L3MBTL1PPARGPPARAKMT2ATDP1
SCHEMBL2530995 0.90 PPARG (0.39) L3MBTL1PPARGPPARAKMT2ATDP1
SCHEMBL2529626 0.90 KMT2A (0.40) L3MBTL1PPARGPPARAKMT2ATDP1
SCHEMBL2525540 0.89 PPARG (0.41) L3MBTL1PPARGPPARAKMT2AAOC3
SCHEMBL2527784 0.89 PPARG (0.43) PPARGPPARAKMT2A
SCHEMBL2525523 0.89 PPARG (0.43) PPARGPPARAKMT2AATM

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 4486/4885PPARG 1096/4885PPARA 381/4885

“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.