SCHEMBL28544243

SCHEMBL28544243

CC(O)CC(=O)NC(CCCCN)C(=O)NC(C)C(=O)NC(CCC(=O)O)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 3/20 0.55
▸ NMT2 O60551 1/20 0.43
▸ NMT1 P30419 1/20 0.43
▸ SLC6A5 Q9Y345 1/20 0.43
▸ GNPAT O15228 2/20 0.42
▸ BACE1 P56817 1/20 0.42
▸ NOD1 Q9Y239 1/20 0.41
▸ SLC15A2 Q16348 1/20 0.41
▸ FURIN P09958 4/20 0.40
▸ CPB2 Q96IY4 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
SCHEMBL21261604 1.00 FOLH1 (0.55) FOLH1NMT2NMT1SLC6A5GNPAT
SCHEMBL29777788 0.90 FOLH1 (0.59) FOLH1NMT2NMT1SLC6A5GNPAT
SCHEMBL29777829 0.86 FOLH1 (0.60) FOLH1NMT2NMT1SLC6A5GNPAT
SCHEMBL30584432 0.86 FOLH1 (0.60) FOLH1NMT2NMT1SLC6A5GNPAT
SCHEMBL29412683 0.86 FOLH1 (0.60) FOLH1NMT2NMT1SLC6A5GNPAT
SCHEMBL29451463 0.86 FOLH1 (0.60) FOLH1NMT2NMT1SLC6A5GNPAT
SCHEMBL29774675 0.86 FOLH1 (0.60) FOLH1NMT2NMT1SLC6A5GNPAT
SCHEMBL29625397 0.86 FOLH1 (0.60) FOLH1NMT2NMT1SLC6A5GNPAT
SCHEMBL29777855 0.86 FOLH1 (0.60) FOLH1NMT2NMT1SLC6A5GNPAT
SCHEMBL29451703 0.86 FOLH1 (0.60) FOLH1NMT2NMT1SLC6A5GNPAT

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
CN-108017555-B Beta-hydroxybutyryl-amino acid compound and preparation method and application thereof 郑州海斯威生物技术有限公司 2021-03-26 — — CN disclosed
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