SCHEMBL12417528

SCHEMBL12417528

C=C(NC(=O)CCN1C(=O)CC(SC)C1=O)NC(=O)CC(CC(=O)NC(=C)NC(=O)CCN1C(=O)CC(SC)C1=O)NC(=O)C(CCCCNC(=O)OCC)NC(=O)OCC

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 5/20 0.33
▸ SIRT2 Q8IXJ6 3/20 0.32
▸ SIRT1 Q96EB6 2/20 0.32
▸ HDAC4 P56524 2/20 0.31
▸ MEF2D Q14814 2/20 0.31
▸ OPRK1 P41145 2/20 0.31
▸ EP300 Q09472 1/20 0.30
▸ SIRT3 Q9NTG7 1/20 0.30
▸ KLK7 P49862 1/20 0.30
▸ KLK5 Q9Y337 1/20 0.30
▸ ACE P12821 1/20 0.30

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
SCHEMBL12038058 0.93 FOLH1 (0.35) FOLH1SIRT2SIRT1HDAC4MEF2D
SCHEMBL277717 0.91 SIRT2 (0.35) FOLH1SIRT2SIRT1HDAC4MEF2D
SCHEMBL14753625 0.90 FOLH1 (0.34) FOLH1SIRT2SIRT1HDAC4MEF2D
SCHEMBL13311706 0.88 SIRT2 (0.34) FOLH1SIRT2SIRT1HDAC4MEF2D
SCHEMBL16441086 0.87 FOLH1 (0.32) FOLH1SIRT2SIRT1OPRK1
SCHEMBL12692608 0.87 FOLH1 (0.36) FOLH1SIRT2SIRT1HDAC4MEF2D
SCHEMBL14753619 0.85 FOLH1 (0.36) FOLH1SIRT2SIRT1HDAC4MEF2D
SCHEMBL277487 0.85 SIRT2 (0.40) FOLH1SIRT2SIRT1HDAC4MEF2D
SCHEMBL13339580 0.84 SIRT2 (0.36) FOLH1SIRT2SIRT1HDAC4MEF2D
SCHEMBL12417525 0.84 SIRT2 (0.37) SIRT2SIRT1HDAC4MEF2DEP300

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-20110171312-A1 MODIFIED THERAPEUTIC PEPTIDES, METHODS OF THEIR PREPARATION AND USE NEKTAR THERAPEUTICS (US) 2011-07-14 — — 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-20110171312-A1 MODIFIED THERAPEUTIC PEPTIDES, METHODS OF THEIR PREPARATION AND USE DNPEP, VIP, PTMS FOLH1 31/4885SIRT2 4150/4885SIRT1 3361/4885

“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.

Send feedback