SCHEMBL29550598

SCHEMBL29550598

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

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 8/20 0.45
▸ FNTA P49354 7/20 0.44
▸ FNTB P49356 7/20 0.44
▸ CTSD P07339 1/20 0.43
▸ BACE2 Q9Y5Z0 1/20 0.41
▸ FURIN P09958 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
SCHEMBL29550853 0.89 BACE1 (0.47) BACE1FNTAFNTBCTSD
SCHEMBL29445196 0.89 BACE1 (0.46) BACE1FNTAFNTBCTSDBACE2
SCHEMBL29445230 0.88 FNTA (0.43) FNTAFNTB
SCHEMBL30052925 0.87 BACE1 (0.48) BACE1FNTAFNTBCTSD
SCHEMBL29688977 0.84 FNTA (0.42) BACE1FNTAFNTBCTSDBACE2
SCHEMBL29645141 0.84 FNTA (0.49) BACE1FNTAFNTBCTSD
SCHEMBL30052493 0.83 FNTA (0.55) BACE1FNTAFNTB
SCHEMBL30279341 0.82 BACE1 (0.40) BACE1FNTAFNTBCTSD
SCHEMBL30272510 0.81 FNTA (0.52) BACE1FNTAFNTBCTSDBACE2
SCHEMBL31683255 0.80 FNTA (0.41) BACE1FNTAFNTBCTSD

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-11339152-B2 Inhibitors VIVORYON THERAPEUTICS N.V. 2022-05-24 — — 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-11339152-B2 Inhibitors GLUL, QPCT, GLS BACE1 1547/4885FNTA 721/4885FNTB 726/4885

“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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