SCHEMBL2529264

SCHEMBL2529264

COc1cc(CC(=O)Oc2ccc(C(O)CN(C)C(=O)OC(C)(C)C)cc2)cc(OC)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 2/20 0.41
L3MBTL1 Q9Y468 3/20 0.38
KMT2A Q03164 1/20 0.37
TACR1 P25103 1/20 0.37
TDP1 Q9NUW8 2/20 0.35
ATM Q13315 1/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
BACE1 P56817 3/20 0.33
CYP2D6 P10635 2/20 0.33
BCHE P06276 1/20 0.33
ADRB2 P07550 1/20 0.33
ACHE P22303 1/20 0.33
KCNH2 Q12809 1/20 0.33
LMNA P02545 1/20 0.33
CYP2C19 P33261 1/20 0.33

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 0.92 KMT2A (0.46) AOC3L3MBTL1KMT2ATDP1ATM
SCHEMBL2527518 0.91 PDGFRB (0.41) AOC3L3MBTL1KMT2ATDP1BACE1
SCHEMBL2526966 0.87 ABL1 (0.47) L3MBTL1KMT2ACYP2D6ADRB2LMNA
SCHEMBL2529626 0.86 KMT2A (0.40) L3MBTL1KMT2ATDP1ATMPPARG
SCHEMBL2527448 0.85 KMT2A (0.41) AOC3L3MBTL1KMT2ATDP1ATM
SCHEMBL2528951 0.85 L3MBTL1 (0.42) AOC3L3MBTL1KMT2ATDP1ATM
SCHEMBL2528484 0.85 AOC3 (0.42) AOC3KMT2ACYP2D6BCHEADRB2
SCHEMBL2527806 0.85 MEN1 (0.40) AOC3L3MBTL1KMT2ATDP1
SCHEMBL2532005 0.85 HSD17B10 (0.44) AOC3L3MBTL1KMT2ATDP1LMNA
SCHEMBL2526481 0.84 L3MBTL1 (0.38) AOC3L3MBTL1KMT2ATDP1ATM

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 AOC3 2105/4885L3MBTL1 4486/4885KMT2A 2317/4885

“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.