SCHEMBL20283589

SCHEMBL20283589

CC(=O)N[C@H]1CSC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC2CCCCC2)NC(=O)COCCOCCNC1=O

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ IDE P14735 9/20 0.41
▸ OPRM1 P35372 5/20 0.38
▸ OPRD1 P41143 5/20 0.38
▸ OPRK1 P41145 3/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ MCL1 Q07820 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
SCHEMBL20283427 0.99 IDE (0.40) IDEOPRM1OPRD1OPRK1MEN1
SCHEMBL22916013 0.93 MMP1 (0.36) IDEOPRM1OPRD1OPRK1MEN1
SCHEMBL22916085 0.92 OPRM1 (0.42) OPRM1OPRD1OPRK1
SCHEMBL20283426 0.92 GHSR (0.39) IDEMEN1
SCHEMBL20283646 0.92 IDE (0.34) IDEOPRM1OPRD1OPRK1MEN1
SCHEMBL20283428 0.91 GHSR (0.34) IDEOPRM1OPRD1OPRK1
SCHEMBL22916030 0.88 OPRM1 (0.41) OPRM1OPRD1OPRK1
SCHEMBL24917456 0.86 CTSS (0.34) IDE
SCHEMBL22916032 0.86 GHSR (0.35) IDEMEN1
SCHEMBL22916029 0.86 GHSR (0.41) OPRM1OPRD1OPRK1

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-11560361-B2 Simplified structural mimetics of AIPS as quorum sensing inhibitors WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2023-01-24 — — US disclosed
US-20180170889-A1 Simplified Structural Mimetics of AIPS as Quorum Sensing Inhibitors WISCONSIN ALUMNI RESEARCH FOUNDATION 2018-06-21 — — 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-11560361-B2 Simplified structural mimetics of AIPS as quorum sensing inhibitors AIPL1, AIP, PYM1 IDE 1870/4885OPRM1 1628/4885OPRD1 2470/4885
US-20180170889-A1 Simplified Structural Mimetics of AIPS as Quorum Sensing Inhibitors AIP, AIPL1, CGAS IDE 1155/4885OPRM1 3375/4885OPRD1 4315/4885

“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.

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