SCHEMBL30066978

SCHEMBL30066978

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

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 15/20 0.52
▸ CTSD P07339 3/20 0.52
▸ FOLH1 Q04609 2/20 0.47
▸ DPP4 P27487 1/20 0.46
▸ DPP8 Q6V1X1 1/20 0.46
▸ DPP9 Q86TI2 1/20 0.46
▸ BACE2 Q9Y5Z0 4/20 0.45
▸ EGFR P00533 1/20 0.44
▸ PTPN1 P18031 1/20 0.43

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
SCHEMBL29777770 0.94 DPP4 (0.51) BACE1CTSDFOLH1DPP4DPP8
SCHEMBL30193517 0.91 DPP4 (0.54) BACE1CTSDFOLH1DPP4DPP8
SCHEMBL29478096 0.90 BACE1 (0.56) BACE1CTSDFOLH1DPP4DPP8
SCHEMBL29777804 0.89 FOLH1 (0.51) BACE1CTSDFOLH1DPP4DPP8
SCHEMBL29437873 0.89 FOLH1 (0.56) BACE1CTSDFOLH1DPP4DPP8
SCHEMBL30463268 0.88 DPP4 (0.56) BACE1CTSDFOLH1DPP4DPP8
SCHEMBL29517333 0.88 DPP4 (0.56) BACE1CTSDFOLH1DPP4DPP8
SCHEMBL30430488 0.87 FOLH1 (0.61) BACE1CTSDFOLH1DPP4DPP8
SCHEMBL30193225 0.87 BACE1 (0.53) BACE1CTSDFOLH1DPP4DPP8
SCHEMBL30480113 0.87 FOLH1 (0.61) BACE1CTSDFOLH1DPP4DPP8

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-115334899-A Methods and compositions for improving taste quality 阿尔门德拉私人有限公司 2022-11-11 — — CN disclosed
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