SCHEMBL30051358

SCHEMBL30051358

CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE P12821 7/20 0.48
XIAP P98170 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
REN P00797 4/20 0.46
KDM4E B2RXH2 1/20 0.46
F2 P00734 1/20 0.46
LMNA P02545 1/20 0.46
LTA4H P09960 1/20 0.46
MAPT P10636 1/20 0.46
PEPD P12955 1/20 0.46
ALOX15 P16050 1/20 0.46
PTGS1 P23219 1/20 0.46
HTR2A P28223 1/20 0.46
PTGS2 P35354 1/20 0.46
HRH1 P35367 1/20 0.46
THPO P40225 1/20 0.46
PMP22 Q01453 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ACE2 Q9BYF1 1/20 0.46

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
SCHEMBL29575481 0.90 XIAP (0.48) ACEXIAPRENKDM4EF2
SCHEMBL30051606 0.90 ACE (0.49) ACEXIAPMEN1KMT2AREN
SCHEMBL30661449 0.88 ACE (0.47) ACEMEN1KMT2ARENKDM4E
SCHEMBL30661445 0.88 ACE (0.47) ACEMEN1KMT2ARENKDM4E
SCHEMBL30051550 0.87 ACE (0.51) ACEMEN1KMT2ARENKDM4E
SCHEMBL31337510 0.86 TGM2 (0.51) ACEXIAPRENTGM2
SCHEMBL29794187 0.86 ACE (0.50) ACEMEN1KMT2ARENKDM4E
SCHEMBL29350794 0.86 ACE (0.50) ACEXIAPRENKDM4EF2
SCHEMBL29723864 0.86 ACE (0.48) ACEXIAPRENKDM4EF2
SCHEMBL30661443 0.85 ACE (0.49) ACEMEN1KMT2ARENKDM4E

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-12622975-B2 Peptide-conjugated prodrugs BRANDEIS UNIVERSITY (US) 2026-05-12 US disclosed
US-20220387610-A1 PEPTIDE-CONJUGATED PRODRUGS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-12-08 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 (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-12622975-B2 Peptide-conjugated prodrugs PEPD, PAM, VIP ACE 1190/4885XIAP 4043/4885MEN1 1217/4885
US-20220387610-A1 PEPTIDE-CONJUGATED PRODRUGS VIP, DNPEP, PEPD ACE 486/4885XIAP 2121/4885MEN1 1147/4885

“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.