SCHEMBL4093181

SCHEMBL4093181

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nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MME P08473 5/20 0.44
TGFBR1 P36897 3/20 0.41
CTSC P53634 1/20 0.39
OPRD1 P41143 4/20 0.39
OPRM1 P35372 3/20 0.39
TERT O14746 2/20 0.37
PTGS1 P23219 1/20 0.36
GSTK1 Q9Y2Q3 1/20 0.36
OPRK1 P41145 1/20 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
SCHEMBL31723030 1.00 MME (0.44) MMETGFBR1CTSCOPRD1OPRM1
SCHEMBL4093176 1.00 MME (0.44) MMETGFBR1CTSCOPRD1OPRM1
SCHEMBL31206455 0.97 MME (0.42) MMETGFBR1CTSCOPRD1OPRM1
SCHEMBL4083063 0.96 OPRM1 (0.43) MMETGFBR1CTSCOPRD1OPRM1
SCHEMBL4083058 0.96 OPRM1 (0.43) MMETGFBR1CTSCOPRD1OPRM1
SCHEMBL4093204 0.92 MME (0.40) MMETGFBR1CTSCOPRD1OPRM1
Trifluoroacetic Acid SCHEMBL16497333 0.90 OPRD1 (0.39) MMETGFBR1CTSCOPRD1OPRM1
SCHEMBL29871252 0.89 MME (0.45) MMETGFBR1OPRD1OPRM1TERT
Trifluoroacetic Acid SCHEMBL4089079 0.89 OPRM1 (0.41) MMEOPRD1OPRM1OPRK1
Trifluoroacetic Acid SCHEMBL4089038 0.89 OPRM1 (0.41) 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 965/4885TGFBR1 2913/4885CTSC 619/4885

“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.