SCHEMBL2529925

SCHEMBL2529925

CN(CC(O)c1ccc(OS(=O)(=O)c2ccc(F)c(Cl)c2)cc1)C(=O)OC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.37
KAT6A Q92794 1/20 0.37
KAT5 Q92993 1/20 0.37
SOS1 Q07889 2/20 0.35
APP P05067 1/20 0.35
CNR2 P34972 1/20 0.34
EGFR P00533 1/20 0.34
RORC P51449 3/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
ENPP1 P22413 2/20 0.34
ENPP3 O14638 1/20 0.34
MMP13 P45452 1/20 0.33
ENPP2 Q13822 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL2529269 0.91 APEX1 (0.47) APEX1KAT6AKAT5EGFRMEN1
SCHEMBL2529738 0.91 EGFR (0.36) KAT6AKAT5EGFRMEN1KMT2A
SCHEMBL2531949 0.90 APEX1 (0.38) APEX1KAT6AKAT5EGFRMEN1
SCHEMBL2528584 0.88 MEN1 (0.45) EGFRMEN1KMT2AENPP1ENPP3
SCHEMBL2526981 0.87 MEN1 (0.35) KAT6AKAT5APPEGFRMEN1
SCHEMBL2526645 0.87 CCR2 (0.38) APEX1KAT6AKAT5CNR2
SCHEMBL2532676 0.87 STS (0.36) MEN1KMT2AMMP13ALDH1A1
SCHEMBL2528461 0.86 EGFR (0.34) KAT6AKAT5EGFRMEN1KMT2A
SCHEMBL2532879 0.86 AKR1C3 (0.42) EGFRMEN1KMT2AENPP1ENPP3
SCHEMBL2528798 0.85 CA1 (0.42) APEX1MEN1KMT2AMMP13ALDH1A1

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 APEX1 3923/4885KAT6A 1834/4885KAT5 272/4885

“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.