SCHEMBL30367266

SCHEMBL30367266

NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ENPEP Q07075 5/20 0.52
MME P08473 4/20 0.50
ACE P12821 3/20 0.49
CPA1 P15085 1/20 0.49
ACE2 Q9BYF1 1/20 0.49
CHRND Q07001 4/20 0.48
CHRNA1 P02708 1/20 0.48
CHRNG P07510 1/20 0.48
CHRNB1 P11230 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
FOLH1 Q04609 1/20 0.47
NAALAD2 Q9Y3Q0 1/20 0.47

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
SCHEMBL29644411 0.96 MME (0.52) ENPEPMMEACECPA1ACE2
SCHEMBL29822475 0.93 MME (0.56) ENPEPMMEACECPA1ACE2
SCHEMBL29602654 0.90 MME (0.63) MMEACECHRNDCHRNA1CHRNG
SCHEMBL29350849 0.90 MME (0.63) MMEACECHRNDCHRNA1CHRNG
SCHEMBL29603463 0.90 MME (0.63) MMEACECHRNDCHRNA1CHRNG
SCHEMBL13588078 0.90 MME (0.63) MMEACECHRNDCHRNA1CHRNG
SCHEMBL29349607 0.89 MME (0.59) MMEACECPA1ACE2
SCHEMBL30900762 0.89 MME (0.59) MMEACECPA1ACE2
SCHEMBL3459805 0.87 ACE (0.60) MMEACECPA1ACE2CHRND
SCHEMBL7110125 0.87 ACE (0.60) MMEACECPA1ACE2CHRND

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-20230121031-A1 MASKED FLUOROGENIC COMPOUNDS AND METHODS OF USING THE SAME RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2023-04-20 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-20230121031-A1 MASKED FLUOROGENIC COMPOUNDS AND METHODS OF USING THE SAME HNRNPAB, HAVCR2, APBA1 ENPEP 178/4885MME 163/4885ACE 561/4885

“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.