SCHEMBL29630420

SCHEMBL29630420

CC(C)[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 7/20 0.52
▸ FOLH1 Q04609 7/20 0.47
▸ NAALAD2 Q9Y3Q0 2/20 0.47
▸ RIMKLA Q8IXN7 1/20 0.47
▸ GNPAT O15228 1/20 0.41
▸ CTSD P07339 1/20 0.41

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
Ammonia Solution, Strong SCHEMBL29404690 0.99 BACE1 (0.52) BACE1FOLH1NAALAD2RIMKLAGNPAT
SCHEMBL30590545 0.97 FOLH1 (0.50) BACE1FOLH1NAALAD2RIMKLA
SCHEMBL29714767 0.94 FOLH1 (0.53) BACE1FOLH1NAALAD2RIMKLAGNPAT
SCHEMBL10480057 0.93 BACE1 (0.50) BACE1FOLH1NAALAD2RIMKLACTSD
SCHEMBL10480048 0.93 BACE1 (0.50) BACE1FOLH1NAALAD2RIMKLACTSD
SCHEMBL31211777 0.91 BACE1 (0.47) BACE1FOLH1NAALAD2RIMKLACTSD
SCHEMBL9622060 0.91 FOLH1 (0.56) FOLH1NAALAD2RIMKLA
SCHEMBL10379815 0.91 FOLH1 (0.56) FOLH1NAALAD2RIMKLA
SCHEMBL156084 0.91 FOLH1 (0.56) FOLH1NAALAD2RIMKLA
SCHEMBL27905698 0.91 FOLH1 (0.56) FOLH1NAALAD2RIMKLA

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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