SCHEMBL21667397

SCHEMBL21667397

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nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ELANE P08246 9/20 0.57
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PTGS1 P23219 1/20 0.35
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL10738651 0.94 ELANE (0.55) ELANEMEN1KMT2APTGS1CA1
SCHEMBL11476865 0.94 ELANE (0.55) ELANEMEN1KMT2APTGS1CA1
SCHEMBL10733750 0.92 ELANE (0.55) ELANEMEN1KMT2APTGS1CA1
SCHEMBL30860741 0.92 ELANE (0.55) ELANEMEN1KMT2APTGS1CA1
SCHEMBL10733755 0.92 ELANE (0.55) ELANEMEN1KMT2APTGS1CA1
SCHEMBL10736041 0.92 ELANE (0.67) ELANEMEN1KMT2APTGS1KDM4E
SCHEMBL10371074 0.92 ELANE (0.67) ELANEMEN1KMT2APTGS1KDM4E
SCHEMBL10735801 0.92 ELANE (0.67) ELANEMEN1KMT2APTGS1KDM4E
SCHEMBL10735805 0.92 ELANE (0.67) ELANEMEN1KMT2APTGS1KDM4E
SCHEMBL10592858 0.88 ELANE (0.52) ELANEMEN1KMT2APTGS1CA1

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-11084833-B2 Antibacterial agents against D,D- and L,D-transpeptidases THE JOHNS HOPKINS UNIVERSITY (US) 2021-08-10 US disclosed
US-20200040005-A1 ANTIBACTERIAL AGENTS AGAINST D,D- AND L,D-TRANSPEPTIDASES THE JOHNS HOPKINS UNIVERSITY 2020-02-06 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 (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-11084833-B2 Antibacterial agents against D,D- and L,D-transpeptidases PEPD, DNPEP, NAALAD2 ELANE 80/4885MEN1 4203/4885KMT2A 4213/4885
US-20200040005-A1 ANTIBACTERIAL AGENTS AGAINST D,D- AND L,D-TRANSPEPTIDASES PEPD, DNPEP, NAALAD2 ELANE 80/4885MEN1 4203/4885KMT2A 4213/4885

“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.