SCHEMBL30006401

SCHEMBL30006401

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

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 3/20 0.46
▸ OPRD1 P41143 3/20 0.46
▸ OPRK1 P41145 1/20 0.44
▸ OPRL1 P41146 5/20 0.42
▸ PRMT1 Q99873 1/20 0.41
▸ NPY1R P25929 2/20 0.39
▸ NPY2R P49146 2/20 0.39
▸ NPY4R P50391 2/20 0.39
▸ NPY5R Q15761 2/20 0.39
▸ IL23R Q5VWK5 2/20 0.39
▸ SIRT2 Q8IXJ6 1/20 0.39
▸ SIRT5 Q9NXA8 1/20 0.39

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
SCHEMBL31393356 0.96 OPRM1 (0.43) OPRM1OPRD1OPRK1OPRL1PRMT1
SCHEMBL30443571 0.92 OPRM1 (0.46) OPRM1OPRD1OPRK1OPRL1NPY1R
SCHEMBL29374718 0.88 TFPI (0.44) OPRM1OPRD1OPRK1PRMT1IL23R
SCHEMBL30006921 0.86 OPRL1 (0.49) OPRL1PRMT1IL23R
SCHEMBL30966635 0.86 OPRL1 (0.50) OPRM1OPRD1OPRL1PRMT1NPY1R
SCHEMBL29470904 0.86 TFPI (0.46) IL23R
SCHEMBL30297059 0.86 IL23R (0.42) OPRL1NPY1RNPY2RNPY4RNPY5R
SCHEMBL29375236 0.85 TFPI (0.43) IL23R
SCHEMBL29816322 0.85 NPY4R (0.46) OPRM1OPRD1OPRK1NPY1RNPY2R
SCHEMBL31236827 0.84 IL23R (0.42) IL23R

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 OPRM1 3782/4885OPRD1 4785/4885OPRK1 4178/4885

“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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