SCHEMBL29630374

SCHEMBL29630374

CSCC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 18/20 0.62
▸ BACE2 Q9Y5Z0 1/20 0.59
▸ CTSD P07339 1/20 0.57

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
SCHEMBL29630499 0.95 NAALAD2 (0.57) BACE1BACE2
SCHEMBL29591515 0.93 BACE1 (0.57) BACE1BACE2CTSD
SCHEMBL30052114 0.93 FNTA (0.57) BACE1
SCHEMBL30626304 0.92 BACE1 (0.55) BACE1BACE2CTSD
SCHEMBL9597693 0.92 LTA4H (0.56) BACE1
SCHEMBL9597700 0.92 LTA4H (0.56) BACE1
SCHEMBL31464939 0.89 BACE1 (0.64) BACE1BACE2CTSD
SCHEMBL30050929 0.88 FNTA (0.59) —
SCHEMBL30498618 0.88 BACE1 (0.65) BACE1BACE2CTSD
SCHEMBL29590487 0.88 BACE1 (0.58) BACE1BACE2CTSD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11807899-B2 Biochemical reaction methods and reagents comprising intrinsically disordered regions Biocrucible Limited 2023-11-07 — — US disclosed
US-20220145378-A1 BIOCHEMICAL REACTION METHODS AND REAGENTS COMPRISING INTRINSICALLY DISORDERED REGIONS Biocrucible Limited (GB) 2022-05-12 — — US disclosed
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