SCHEMBL5130164

SCHEMBL5130164

C[C@@H](O)[C@H](NCc1ccc(C(=O)O)cc1)C(=O)NO

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEP1B Q16820 7/20 0.58
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 2/20 0.43
ADAM17 P78536 1/20 0.42
ANPEP P15144 1/20 0.42

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
SCHEMBL2258599 0.96 MEP1B (0.54) MEP1BKMT2A
SCHEMBL404304 0.84 ALDH1A1 (0.52) MEP1BALDH1A1ADAM17ANPEP
SCHEMBL399676 0.84 ALDH1A1 (0.52) MEP1BALDH1A1ADAM17ANPEP
SCHEMBL12064314 0.84 ALDH1A1 (0.52) MEP1BALDH1A1ADAM17ANPEP
SCHEMBL399832 0.84 ALDH1A1 (0.52) MEP1BALDH1A1ADAM17ANPEP
SCHEMBL5129334 0.82 MEP1B (0.49) MEP1B
SCHEMBL2876648 0.82 MEP1B (0.48) MEP1BKMT2AALDH1A1ANPEP
SCHEMBL404739 0.82 MEP1B (0.48) MEP1BADAM17ANPEP
SCHEMBL404740 0.82 MEP1B (0.48) MEP1BADAM17ANPEP
SCHEMBL5131869 0.81 MEP1B (0.43) MEP1BADAM17

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-20080269221-A1 ANTIBACTERIAL AGENTS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2008-10-30 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-20080269221-A1 ANTIBACTERIAL AGENTS MRPL21, SI, PGLS MEP1B 1047/4885KMT2A 4800/4885ALDH1A1 782/4885

“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.