SCHEMBL26211162

SCHEMBL26211162

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

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 1/20 0.30
AAK1 Q2M2I8 1/20 0.30
HDAC6 Q9UBN7 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
SCHEMBL25384121 1.00 MMP13 (0.30) MMP13AAK1HDAC6
SCHEMBL25186344 0.86 AAK1 (0.31) MMP13AAK1HDAC6
SCHEMBL31407614 0.86 AAK1 (0.31) MMP13AAK1HDAC6
SCHEMBL25186343 0.86 AAK1 (0.31) MMP13AAK1HDAC6
SCHEMBL2160514 0.84 CA1 (0.33) MMP13AAK1HDAC6
SCHEMBL67120 0.84 CA1 (0.33) MMP13AAK1HDAC6
SCHEMBL59435 0.84 CA1 (0.33) MMP13AAK1HDAC6
SCHEMBL25385348 0.83 CA12 (0.36) AAK1
SCHEMBL31287322 0.83 MMP13 (0.30) MMP13AAK1HDAC6
SCHEMBL6843570 0.82 AAK1 (0.32) MMP13AAK1HDAC6

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 4 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
US-20230278996-A1 YKL-40 INHIBITORS AND THEIR THERAPEUTIC APPLICATIONS MOLECURE S.A. (PL) 2023-09-07 US disclosed
CN-108794422-B Heterocyclic compounds as PD-L1 inhibitors 南京圣和药业股份有限公司 2022-07-01 CN 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 (2 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 MMP13 2905/4885AAK1 4583/4885HDAC6 1713/4885
US-20230278996-A1 YKL-40 INHIBITORS AND THEIR THERAPEUTIC APPLICATIONS CHI3L1, CHI3L2, CHIA MMP13 645/4885AAK1 1976/4885HDAC6 329/4885

“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.