SCHEMBL13254722

SCHEMBL13254722

CN[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](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](CCCCN)C(N)=O)[C@@H](C)O)[C@@H](C)O

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ IL23R Q5VWK5 15/20 0.54
▸ OPRK1 P41145 3/20 0.51
▸ OPRM1 P35372 2/20 0.51
▸ OPRD1 P41143 2/20 0.51
▸ TFPI P10646 1/20 0.49
▸ SYK P43405 1/20 0.48

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
SCHEMBL13209217 0.93 IL23R (0.61) IL23RTFPISYK
SCHEMBL29531748 0.87 OPRD1 (0.53) IL23ROPRK1OPRM1OPRD1
SCHEMBL30061253 0.85 F2 (0.54) IL23ROPRK1OPRM1OPRD1TFPI
SCHEMBL17176233 0.84 NAALAD2 (0.51) IL23R
SCHEMBL31415958 0.84 OPRD1 (0.50) IL23ROPRK1OPRM1OPRD1
SCHEMBL24324740 0.83 NPY1R (0.55) OPRK1OPRM1OPRD1
SCHEMBL15317805 0.83 OPRM1 (0.56) IL23ROPRK1OPRM1OPRD1SYK
SCHEMBL29826102 0.82 KEAP1 (0.46) IL23ROPRK1OPRM1OPRD1
SCHEMBL25627431 0.82 APC (0.52) IL23RTFPI
SCHEMBL31415939 0.82 OPRM1 (0.53) OPRK1OPRM1OPRD1TFPI

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8431111-B2 Peptide imaging agents GE HEALTHCARE LIMITED (GB) 2013-04-30 — — US disclosed
US-20100178253-A1 PEPTIDE IMAGING AGENTS GE HEALTHCARE LIMITED (GB) 2010-07-15 — — US disclosed
US-20100178253-A1 PEPTIDE IMAGING AGENTS GE HEALTHCARE LIMITED (GB) 2010-07-15 — — 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-20100178253-A1 PEPTIDE IMAGING AGENTS VIP, GRPR, MERTK IL23R 2543/4885OPRK1 2160/4885OPRM1 1882/4885

“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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