SCHEMBL4094024

SCHEMBL4094024

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nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.40
OPRD1 P41143 6/20 0.40
OPRM1 P35372 4/20 0.40
OPRK1 P41145 2/20 0.39
SCN9A Q15858 3/20 0.36

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
SCHEMBL4082757 0.91 OPRD1 (0.33) MMEOPRD1OPRM1OPRK1
SCHEMBL4100066 0.88 MME (0.34) MMEOPRD1OPRM1OPRK1
Trifluoroacetic Acid SCHEMBL4094019 0.87 OPRD1 (0.45) MMEOPRD1OPRM1OPRK1
SCHEMBL4089047 0.87 OPRM1 (0.37) MMEOPRD1OPRM1OPRK1
SCHEMBL4082724 0.81 OPRM1 (0.33) OPRD1OPRM1OPRK1
SCHEMBL29700057 0.81 MME (0.54) MMEOPRD1OPRM1OPRK1
SCHEMBL5072589 0.80 OPRM1 (0.36) OPRD1OPRM1OPRK1
SCHEMBL2367297 0.79 MME (0.35) MME
SCHEMBL5069124 0.79 OPRM1 (0.38) OPRD1OPRM1OPRK1SCN9A
SCHEMBL30099535 0.78 FOLH1 (0.48) MMEOPRD1OPRM1OPRK1

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-8076285-B2 Lysobactin amides AICURIS GMBH & CO. KG (DE) 2011-12-13 US disclosed
US-20090203582-A1 LYSOBACTIN AMIDES BAYER HEALTHCARE AG (DE) 2009-08-13 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-20090203582-A1 LYSOBACTIN AMIDES AADAT, HAMP, DLST MME 965/4885OPRD1 2570/4885OPRM1 1981/4885

“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.