SCHEMBL4092095

SCHEMBL4092095

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nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34
KEAP1 Q14145 1/20 0.34
NPY4R P50391 6/20 0.34
NPY1R P25929 5/20 0.34
NPY2R P49146 4/20 0.34
NPY5R Q15761 4/20 0.34
OPRL1 P41146 3/20 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
SCHEMBL4094614 1.00 OPRM1 (0.34) OPRM1OPRD1OPRK1KEAP1NPY4R
SCHEMBL4082398 0.90 NPY4R (0.35) OPRM1OPRD1OPRK1KEAP1NPY4R
SCHEMBL4098733 0.89 NPY4R (0.39) NPY4RNPY1RNPY2RNPY5R
SCHEMBL4092740 0.88 NPY4R (0.36) KEAP1NPY4RNPY1RNPY2RNPY5R
SCHEMBL4092349 0.85 NPY4R (0.38) NPY4RNPY1RNPY2RNPY5R
SCHEMBL4086617 0.83 RXFP1 (0.35) KEAP1OPRL1
SCHEMBL4252640 0.82 OPRM1 (0.54) OPRM1OPRD1OPRK1KEAP1NPY4R
SCHEMBL4082548 0.81 NPY4R (0.38) NPY4RNPY1RNPY2RNPY5R
SCHEMBL4089663 0.81 NPY4R (0.38) NPY4RNPY1RNPY2RNPY5R
SCHEMBL27766371 0.81 ENPEP (0.43)

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 OPRM1 1981/4885OPRD1 2570/4885OPRK1 3341/4885

“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.