SCHEMBL30005436

SCHEMBL30005436

C[C@@H](O)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ IL23R Q5VWK5 8/20 0.45
▸ OPRL1 P41146 4/20 0.43
▸ CXCR4 P61073 1/20 0.43
▸ KEAP1 Q14145 1/20 0.42

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
SCHEMBL29940601 0.97 IL23R (0.46) IL23RCXCR4
SCHEMBL22807693 0.95 OPRL1 (0.46) IL23ROPRL1CXCR4KEAP1
SCHEMBL22807629 0.95 OPRL1 (0.46) IL23ROPRL1CXCR4KEAP1
SCHEMBL22807630 0.94 OPRL1 (0.46) IL23ROPRL1CXCR4KEAP1
SCHEMBL30577893 0.93 IL23R (0.47) IL23R
SCHEMBL31236827 0.93 IL23R (0.42) IL23RCXCR4KEAP1
SCHEMBL30782822 0.91 IL23R (0.45) IL23RCXCR4
SCHEMBL29540080 0.89 NPY4R (0.43) —
SCHEMBL31654013 0.89 IL23R (0.48) IL23RCXCR4
SCHEMBL29378785 0.88 FNTA (0.46) —

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-20220362381-A1 REMOTELY TRIGGERED THERAPY BAMBU VAULT LLC (US) 2022-11-17 — — 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-20220362381-A1 REMOTELY TRIGGERED THERAPY CD47, HSP90AA1, HSF1 IL23R 1657/4885OPRL1 3621/4885CXCR4 840/4885

“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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