SCHEMBL30486016

SCHEMBL30486016

COc1ccc(C=CC(=O)C(O)C(O)CO)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.59
F3 P13726 2/20 0.58
THRB P10828 1/20 0.57
ATM Q13315 1/20 0.57
LMNA P02545 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
HDAC3 O15379 2/20 0.54
HDAC1 Q13547 2/20 0.54
HDAC2 Q92769 2/20 0.54
HDAC8 Q9BY41 2/20 0.54
HDAC6 Q9UBN7 2/20 0.54
RAB9A P51151 2/20 0.52
NPC1 O15118 1/20 0.52
TAS1R3 Q7RTX0 3/20 0.52
TAS1R1 Q7RTX1 3/20 0.52
BACE1 P56817 1/20 0.51
HDAC4 P56524 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50

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
SCHEMBL3133036 0.83 MMP2 (0.59) GSK3BF3HDAC3HDAC1HDAC2
SCHEMBL30864651 0.83 MMP2 (0.59) GSK3BF3HDAC3HDAC1HDAC2
4-Methoxycinnamic Acid SCHEMBL28334458 0.82 THRB (0.76) GSK3BF3THRBATMLMNA
SCHEMBL30791440 0.81 MMP9 (0.63) GSK3BF3THRBLMNATDP1
SCHEMBL2266493 0.81 MMP9 (0.63) GSK3BF3THRBLMNATDP1
SCHEMBL4790318 0.81 MAPT (0.50) F3LMNATDP1HDAC3HDAC1
SCHEMBL21356927 0.79 F3 (0.68) GSK3BF3THRBATMLMNA
SCHEMBL21356925 0.79 F3 (0.68) GSK3BF3THRBATMLMNA
SCHEMBL10843269 0.79 F3 (0.68) GSK3BF3THRBATMLMNA
SCHEMBL10843273 0.79 F3 (0.68) GSK3BF3THRBATMLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230210755-A1 FUNCTIONAL SKIN COATING POLYMER THE JOHNS HOPKINS UNIVERSITY 2023-07-06 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-20230210755-A1 FUNCTIONAL SKIN COATING POLYMER CUTA, PUF60, SUN2 GSK3B 4093/4885F3 502/4885THRB 4599/4885

“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.