SCHEMBL25969641

SCHEMBL25969641

C[C@H](COCCN(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)n1nccc1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.39
AAK1 Q2M2I8 2/20 0.33
BACE1 P56817 1/20 0.32
BACE2 Q9Y5Z0 1/20 0.32
DGAT1 O75907 1/20 0.31
PRMT5 O14744 1/20 0.30
WDR77 Q9BQA1 1/20 0.30

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
SCHEMBL25969633 0.81 USP30 (0.37) USP30AAK1BACE1BACE2DGAT1
SCHEMBL25969622 0.76 USP30 (0.39) USP30AAK1BACE1BACE2DGAT1
SCHEMBL25969654 0.74 USP30 (0.37) USP30AAK1BACE1BACE2DGAT1
SCHEMBL24192519 0.73 USP30 (0.36) USP30AAK1BACE1BACE2PRMT5
SCHEMBL18391604 0.69 AAK1 (0.49) USP30AAK1BACE1BACE2DGAT1
SCHEMBL25969661 0.67 USP30 (0.37) USP30AAK1BACE1BACE2DGAT1
SCHEMBL15412342 0.67 USP30 (0.40) USP30AAK1BACE1BACE2DGAT1
SCHEMBL25969636 0.67 L3MBTL1 (0.32)
SCHEMBL1485368 0.66 ALDH1A1 (0.35)
SCHEMBL16491274 0.64 AAK1 (0.55) USP30AAK1BACE1BACE2DGAT1

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-20230257396-A1 MACROCYCLES AND THEIR USE BLOSSOMHILL THERAPEUTICS INC (US) 2023-08-17 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-20230257396-A1 MACROCYCLES AND THEIR USE VHL, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, DLD USP30 4382/4885AAK1 4411/4885BACE1 2544/4885

“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.