SCHEMBL31407669

SCHEMBL31407669

CCCOC[C@@H](C(=O)O)N(C)C(=O)OC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 2/20 0.35
MMP13 P45452 1/20 0.35
HSD17B10 Q99714 1/20 0.34
TDP1 Q9NUW8 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
SCHEMBL31407757 0.88 AAK1 (0.36) AAK1MMP13
SCHEMBL31407599 0.87 MMP13 (0.34) AAK1MMP13
SCHEMBL25185802 0.85 AAK1 (0.38) AAK1MMP13TDP1
SCHEMBL4445820 0.84 MMP13 (0.38) AAK1MMP13
SCHEMBL25185703 0.84 MMP13 (0.38) AAK1MMP13
SCHEMBL4452992 0.84 MMP13 (0.38) AAK1MMP13
SCHEMBL18686904 0.83 ITGB3 (0.33) AAK1MMP13
SCHEMBL20826464 0.81 HDAC1 (0.41) AAK1MMP13TDP1
SCHEMBL29233850 0.81 MMP13 (0.38) AAK1MMP13
SCHEMBL29400845 0.81 MMP13 (0.38) AAK1MMP13

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-20260015313-A1 AMINO ACID ACTIVE ESTER AND SALT THEREOF PEPTIDREAM INC (JP) 2026-01-15 US disclosed
EP-4534524-A1 AMINO ACID ACTIVE ESTER AND SALT THEREOF PeptiDream Inc. (JP) 2025-04-09 EP 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-20260015313-A1 AMINO ACID ACTIVE ESTER AND SALT THEREOF NSUN3, BCAT1, SLC43A1 AAK1 4583/4885MMP13 2905/4885HSD17B10 1075/4885

“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.