SCHEMBL4083058

SCHEMBL4083058

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nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 6/20 0.43
OPRD1 P41143 6/20 0.43
MME P08473 5/20 0.41
TGFBR1 P36897 3/20 0.38
CTSC P53634 1/20 0.37
NMT2 O60551 1/20 0.37
NMT1 P30419 1/20 0.37
OPRK1 P41145 3/20 0.37
TERT O14746 1/20 0.35

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
SCHEMBL4083063 1.00 OPRM1 (0.43) OPRM1OPRD1MMETGFBR1CTSC
SCHEMBL31723030 0.96 MME (0.44) OPRM1OPRD1MMETGFBR1CTSC
SCHEMBL4093176 0.96 MME (0.44) OPRM1OPRD1MMETGFBR1CTSC
SCHEMBL4093181 0.96 MME (0.44) OPRM1OPRD1MMETGFBR1CTSC
SCHEMBL31206455 0.93 MME (0.42) OPRM1OPRD1MMETGFBR1CTSC
Trifluoroacetic Acid SCHEMBL4089079 0.93 OPRM1 (0.41) OPRM1OPRD1MMEOPRK1
Trifluoroacetic Acid SCHEMBL4089038 0.93 OPRM1 (0.41) OPRM1OPRD1MMEOPRK1
SCHEMBL30063535 0.92 ACE (0.46) OPRM1OPRD1MMENMT2NMT1
SCHEMBL4093204 0.90 MME (0.40) OPRM1OPRD1MMETGFBR1CTSC
SCHEMBL31513322 0.88 MME (0.42) OPRM1OPRD1MMECTSCOPRK1

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 2570/4885MME 965/4885

“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.