SCHEMBL3046202

SCHEMBL3046202

C=CCOC(=O)C[C@H](O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KLK5 Q9Y337 3/20 0.63
PSEN1 P49768 3/20 0.49
PSEN2 P49810 3/20 0.49
APH1B Q8WW43 3/20 0.49
NCSTN Q92542 3/20 0.49
APH1A Q96BI3 3/20 0.49
PSENEN Q9NZ42 3/20 0.49
REN P00797 8/20 0.49
APP P05067 1/20 0.49
ATM Q13315 1/20 0.47

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
SCHEMBL6653213 0.87 KLK5 (0.68) KLK5PSEN1PSEN2APH1BNCSTN
SCHEMBL10606303 0.87 KLK5 (0.68) KLK5PSEN1PSEN2APH1BNCSTN
SCHEMBL6876159 0.87 KLK5 (0.68) KLK5PSEN1PSEN2APH1BNCSTN
SCHEMBL9833378 0.85 KLK5 (0.72) KLK5PSEN1PSEN2APH1BNCSTN
SCHEMBL9482833 0.85 KLK5 (0.72) KLK5PSEN1PSEN2APH1BNCSTN
SCHEMBL5831798 0.83 KLK5 (0.50) KLK5PSEN1PSEN2APH1BNCSTN
SCHEMBL9832414 0.83 KLK5 (0.71) KLK5PSEN1PSEN2APH1BNCSTN
SCHEMBL6873021 0.83 KLK5 (0.71) KLK5PSEN1PSEN2APH1BNCSTN
SCHEMBL8787243 0.83 KLK5 (0.71) KLK5PSEN1PSEN2APH1BNCSTN
SCHEMBL9815894 0.83 KLK5 (0.71) KLK5PSEN1PSEN2APH1BNCSTN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2089416-B1 DEPSIPEPTIDES AND THEIR THERAPEUTIC USE UNIV SOUTHAMPTON (GB) 2014-02-26 EP disclosed
US-8247372-B2 Depsipeptides and their therapeutic use UNIVERSITY OF SOUTHAMPTON (GB) 2012-08-21 US disclosed
US-8247372-B2 Depsipeptides and their therapeutic use UNIVERSITY OF SOUTHAMPTON (GB) 2012-08-21 US disclosed
US-8247372-B2 Depsipeptides and their therapeutic use UNIVERSITY OF SOUTHAMPTON (GB) 2012-08-21 US disclosed
US-20100056434-A1 Depsipeptides and Their Therapeutic Use UNIVERSITY OF SOUTHAMPTON (GB) 2010-03-04 US disclosed
US-20100056434-A1 Depsipeptides and Their Therapeutic Use UNIVERSITY OF SOUTHAMPTON (GB) 2010-03-04 US disclosed
US-20100056434-A1 Depsipeptides and Their Therapeutic Use UNIVERSITY OF SOUTHAMPTON (GB) 2010-03-04 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-20100056434-A1 Depsipeptides and Their Therapeutic Use HDAC11, HDAC1, HDAC6 KLK5 3408/4885PSEN1 3445/4885PSEN2 4163/4885

“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.