SCHEMBL9213993

SCHEMBL9213993

CC(C)C[C@H](NC(=O)[C@H](C)N)C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 1/20 0.46
▸ DPP4 P27487 1/20 0.44
▸ ERAP2 Q6P179 2/20 0.43
▸ ERAP1 Q9NZ08 2/20 0.43
▸ LNPEP Q9UIQ6 2/20 0.43
▸ MMP2 P08253 2/20 0.42
▸ MMP9 P14780 2/20 0.42
▸ MMP8 P22894 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ HPGDS O60760 2/20 0.41
▸ LAP3 P28838 3/20 0.41
▸ CNR2 P34972 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ FCER2 P06734 2/20 0.40
▸ MMP1 P03956 1/20 0.40
▸ ECE1 P42892 1/20 0.39

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
SCHEMBL23484144 1.00 NOD1 (0.46) NOD1DPP4ERAP2ERAP1LNPEP
SCHEMBL18862286 1.00 NOD1 (0.46) NOD1DPP4ERAP2ERAP1LNPEP
SCHEMBL14298799 0.88 ALDH1A1 (0.47) NOD1DPP4MMP2MMP9MMP8
SCHEMBL27579877 0.87 DPP4 (0.40) NOD1DPP4ERAP2ERAP1LNPEP
SCHEMBL27579872 0.87 DPP4 (0.40) NOD1DPP4ERAP2ERAP1LNPEP
SCHEMBL10363299 0.86 SLC7A5 (0.47) ERAP2ERAP1LNPEPMMP2MMP9
SCHEMBL10363301 0.86 SLC7A5 (0.47) ERAP2ERAP1LNPEPMMP2MMP9
SCHEMBL22623434 0.86 ALDH1A1 (0.44) ERAP2ERAP1LNPEPMMP2MMP9
SCHEMBL14268997 0.86 ALDH1A1 (0.44) ERAP2ERAP1LNPEPMMP2MMP9
SCHEMBL24915226 0.86 ALDH1A1 (0.44) ERAP2ERAP1LNPEPMMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240167070-A1 METHODS FOR CYCLIZATION OF (POLY)PEPTIDES COMPRISING Ny-HYDROXY- OR Ny-AMINO-L-ASPARAGINE NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2024-05-23 — — US disclosed
US-10851367-B2 Tissue-specific genome engineering using CRISPR-Cas9 PFIZER INC. (US) 2020-12-01 — — US disclosed
EP-0295316-B1 Antitumor amino acid and peptide derivatives of 1,4-bis[ (aminoalkyl and hydroxyaminoalkyl)- amino]-5,8 dihydroxyanthraquinones AMERICAN CYANAMID CO (US) 1995-11-08 — — 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 (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-20240167070-A1 METHODS FOR CYCLIZATION OF (POLY)PEPTIDES COMPRISING Ny-HYDROXY- OR Ny-AMINO-L-ASPARAGINE ANPEP, DNPEP, ASNS NOD1 213/4885DPP4 545/4885ERAP2 653/4885
US-10851367-B2 Tissue-specific genome engineering using CRISPR-Cas9 ASGR1, LDLR, HAVCR2 NOD1 2140/4885DPP4 2149/4885ERAP2 411/4885

“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.

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