SCHEMBL25901374

SCHEMBL25901374

CC(=O)C[C@@H]1NC(=O)CNC2(CNC(=O)[C@H](CC(C)C)NC1=O)CN(C(=O)OC(C)(C)C)C2

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DDB1 Q16531 4/20 0.34
▸ CRBN Q96SW2 4/20 0.34
▸ ITGB3 P05106 3/20 0.33
▸ ITGA2B P08514 1/20 0.33
▸ ITGAV P06756 6/20 0.33
▸ ITGB8 P26012 4/20 0.33
▸ MMP3 P08254 1/20 0.33
▸ ADAM17 P78536 1/20 0.33
▸ ITGB6 P18564 1/20 0.32
▸ ITGB5 P18084 1/20 0.31

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
SCHEMBL21428995 0.81 POLB (0.46) —
SCHEMBL21428994 0.81 MMP3 (0.39) DDB1CRBNITGB3ITGAVITGB8
SCHEMBL25901357 0.79 ITGB3 (0.34) ITGB3ITGA2BITGAVITGB8ITGB6
SCHEMBL26089962 0.74 CRBN (0.38) DDB1CRBN
SCHEMBL21428993 0.71 L3MBTL1 (0.39) ADAM17
SCHEMBL21430262 0.70 HDAC3 (0.40) —
SCHEMBL25903249 0.66 ITGB3 (0.32) ITGB3ITGA2B
SCHEMBL29392706 0.66 USP30 (0.40) DDB1CRBN
SCHEMBL38665961 0.65 DDB1 (0.39) DDB1CRBN
SCHEMBL6438511 0.62 ITGB3 (0.41) ITGB3ITGA2BITGAVITGB8ITGB6

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-11713339-B2 Macrocyclization of peptidomimetics UNIVERSITY OF WARWICK (GB) 2023-08-01 — — 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-11713339-B2 Macrocyclization of peptidomimetics NGLY1, MAX, PTMA DDB1 2415/4885CRBN 415/4885ITGB3 4027/4885

“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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