SCHEMBL26211712

SCHEMBL26211712

CC(C)NC(C)(C)C(=O)N[C@H](Cc1cccc2ccccc12)C(=O)NCC(=O)NC(C)(C)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H](Cc1cccc2ccccc12)C(=O)C(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 1/20 0.45
▸ CTSS P25774 1/20 0.44
▸ CTSK P43235 1/20 0.44
▸ HRH4 Q9H3N8 1/20 0.44
▸ PSMB5 P28074 5/20 0.42
▸ PSMB8 P28062 4/20 0.42
▸ MMP9 P14780 2/20 0.42
▸ MMP8 P22894 2/20 0.42
▸ MMP14 P50281 1/20 0.42
▸ MME P08473 1/20 0.41
▸ ACE P12821 1/20 0.41
▸ CPA1 P15085 1/20 0.41
▸ ACE2 Q9BYF1 1/20 0.41
▸ MMP2 P08253 1/20 0.40
▸ CTSD P07339 1/20 0.40
▸ LCK P06239 2/20 0.39
▸ TACR2 P21452 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ MMP1 P03956 1/20 0.38

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
SCHEMBL26211765 0.93 OPRD1 (0.49) OPRD1CTSSCTSKHRH4PSMB5
SCHEMBL26211704 0.85 OPRD1 (0.45) OPRD1CTSSCTSK
SCHEMBL26211758 0.74 OPRD1 (0.49) OPRD1PSMB9
SCHEMBL25475251 0.70 OPRD1 (0.52) OPRD1CTSSCTSK
SCHEMBL7265315 0.69 HRH4 (0.69) HRH4PSMB5MMP9MMP8MMP14
SCHEMBL25503977 0.68 PSMB5 (0.48) OPRD1CTSSPSMB5MMP9MMP8
SCHEMBL20816774 0.67 MMP9 (0.48) OPRD1CTSSCTSKHRH4PSMB5
SCHEMBL20816637 0.67 MMP9 (0.48) OPRD1CTSSCTSKHRH4PSMB5
SCHEMBL20802463 0.67 NPSR1 (0.52) CTSSCTSKMMEACECPA1
SCHEMBL6163670 0.67 CTSS (0.61) CTSSCTSKHRH4MMP9MMP8

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-11746126-B2 Bicyclic peptide ligands with detectable moieties and uses thereof Bicyclerd Limited (GB) 2023-09-05 — — 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-11746126-B2 Bicyclic peptide ligands with detectable moieties and uses thereof VIP, NGLY1, GRPR OPRD1 3256/4885CTSS 1469/4885CTSK 575/4885

“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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