SCHEMBL31433283

SCHEMBL31433283

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nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAALAD2 Q9Y3Q0 1/20 0.52
MME P08473 5/20 0.51
BACE1 P56817 5/20 0.51
GNPAT O15228 1/20 0.47
ACE P12821 2/20 0.47
CPA1 P15085 2/20 0.47
ACE2 Q9BYF1 2/20 0.47
ECE1 P42892 1/20 0.47
CTSD P07339 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
SCHEMBL30272495 0.95 GNPAT (0.53) NAALAD2MMEBACE1GNPATECE1
SCHEMBL30903452 0.93 BACE1 (0.57) NAALAD2MMEBACE1CTSD
SCHEMBL29652313 0.93 NAALAD2 (0.54) NAALAD2MMEBACE1GNPATACE
SCHEMBL29531743 0.91 NAALAD2 (0.64) NAALAD2MMEBACE1CTSD
SCHEMBL30688829 0.91 GNPAT (0.54) NAALAD2MMEBACE1GNPATACE
SCHEMBL31672252 0.91 GNPAT (0.54) NAALAD2MMEBACE1GNPATACE
SCHEMBL31474554 0.91 BACE1 (0.56) NAALAD2MMEBACE1GNPATCTSD
SCHEMBL29733676 0.91 NAALAD2 (0.64) NAALAD2MMEBACE1CTSD
SCHEMBL30123399 0.90 MME (0.51) NAALAD2MMEBACE1GNPATACE
SCHEMBL31720880 0.89 BACE1 (0.61) NAALAD2BACE1CTSD

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-20250074942-A1 COMPOSITIONS AND METHODS FOR COVALENT PEPTIDE-BASED MODULATORS OF HLA-E CALICO LIFE SCIENCES LLC (US) 2025-03-06 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-20250074942-A1 COMPOSITIONS AND METHODS FOR COVALENT PEPTIDE-BASED MODULATORS OF HLA-E MICA, CD74, HLA-DRB1 NAALAD2 1237/4885MME 130/4885BACE1 2095/4885

“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.