SCHEMBL15317805

SCHEMBL15317805

CC(O)C(NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCCCNC(=O)CON)C(N)=O)C(C)O

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 3/20 0.56
▸ OPRD1 P41143 3/20 0.56
▸ OPRK1 P41145 3/20 0.56
▸ IL23R Q5VWK5 16/20 0.52
▸ SYK P43405 1/20 0.49

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
SCHEMBL18505641 0.88 IL23R (0.56) OPRM1OPRD1OPRK1IL23R
SCHEMBL29531748 0.85 OPRD1 (0.53) OPRM1OPRD1OPRK1IL23R
SCHEMBL13209217 0.84 IL23R (0.61) IL23RSYK
SCHEMBL13254722 0.83 IL23R (0.54) OPRM1OPRD1OPRK1IL23RSYK
SCHEMBL30061253 0.80 F2 (0.54) OPRM1OPRD1OPRK1IL23R
SCHEMBL30401130 0.79 OPRD1 (0.51) OPRM1OPRD1OPRK1IL23R
SCHEMBL29826102 0.78 KEAP1 (0.46) OPRM1OPRD1OPRK1IL23R
SCHEMBL31415958 0.78 OPRD1 (0.50) OPRM1OPRD1OPRK1IL23R
SCHEMBL30724873 0.77 TFPI (0.55) OPRM1OPRD1OPRK1IL23R
SCHEMBL29733394 0.77 OPRD1 (0.51) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130274436-A1 USE OF ANILINE IN THE RADIOSTABILIZATION OF OXIME LIGATION GE HEALTHCARE LIMITED (GB) 2013-10-17 — — 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-20130274436-A1 USE OF ANILINE IN THE RADIOSTABILIZATION OF OXIME LIGATION INMT, LIG4, LIG3 OPRM1 1366/4885OPRD1 1730/4885OPRK1 1079/4885

“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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