SCHEMBL23366241

SCHEMBL23366241

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

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 2/20 0.42
CA2 P00918 5/20 0.38
CA1 P00915 4/20 0.38
ENPEP Q07075 3/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
PTPN1 P18031 1/20 0.35
PDCD1LG2 Q9BQ51 1/20 0.34
CD274 Q9NZQ7 1/20 0.34
ITGB2 P05107 1/20 0.34
ICAM1 P05362 1/20 0.34
ITGAL P20701 1/20 0.34
PRSS1 P07477 2/20 0.34
TMPRSS15 P98073 2/20 0.34
BACE1 P56817 1/20 0.33

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
SCHEMBL23366203 0.93 ENPEP (0.40) ECE1ENPEPPTPN1PRSS1TMPRSS15
SCHEMBL23366240 0.93 ENPEP (0.40) ECE1ENPEPPTPN1PRSS1TMPRSS15
SCHEMBL23366206 0.93 ENPEP (0.40) ECE1ENPEPPTPN1PRSS1TMPRSS15
SCHEMBL1246595 0.81 ECE1 (0.53) ECE1CA2CA1MEN1KMT2A
SCHEMBL7258586 0.81 ECE1 (0.53) ECE1CA2CA1MEN1KMT2A
SCHEMBL150536 0.81 ECE1 (0.53) ECE1CA2CA1MEN1KMT2A
SCHEMBL6852847 0.81 ECE1 (0.53) ECE1CA2CA1MEN1KMT2A
SCHEMBL6136566 0.81 ECE1 (0.53) ECE1CA2CA1MEN1KMT2A
SCHEMBL7148009 0.81 ECE1 (0.53) ECE1CA2CA1MEN1KMT2A
SCHEMBL31182997 0.81 ECE1 (0.53) ECE1CA2CA1MEN1KMT2A

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-11007274-B2 Compounds for medicinal applications AusVir Therapeutics Pty Ltd (AU) 2021-05-18 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-11007274-B2 Compounds for medicinal applications HAVCR2, ENGASE, DNPEP ECE1 594/4885CA2 246/4885CA1 446/4885

“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.