SCHEMBL29876337

SCHEMBL29876337

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 3/20 0.42
▸ DPP7 Q9UHL4 1/20 0.41
▸ CTSC P53634 3/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ PRCP P42785 1/20 0.37
▸ CALCRL Q16602 1/20 0.37
▸ CTSD P07339 1/20 0.36
▸ BACE1 P56817 1/20 0.36
▸ CAPN1 P07384 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36

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
SCHEMBL30370189 0.92 REN (0.49) RENDPP7MEN1KMT2ACTSD
SCHEMBL30052156 0.92 DPP7 (0.42) RENDPP7CTSCMEN1KMT2A
SCHEMBL30511778 0.89 DPP7 (0.42) RENDPP7CTSCMEN1KMT2A
SCHEMBL30051623 0.88 REN (0.49) RENDPP7CTSCMEN1KMT2A
SCHEMBL29641658 0.88 CALCRL (0.45) RENDPP7CTSCMEN1KMT2A
SCHEMBL30423389 0.88 DPP7 (0.41) RENDPP7CTSCMEN1KMT2A
SCHEMBL29762027 0.88 MEN1 (0.45) RENDPP7CTSCMEN1KMT2A
SCHEMBL30051103 0.86 DPP7 (0.43) RENDPP7CTSCMEN1KMT2A
SCHEMBL29726368 0.86 DPP7 (0.43) RENDPP7CTSCMEN1KMT2A
SCHEMBL31688177 0.86 PDCD1LG2 (0.45) RENDPP7CTSCMEN1KMT2A

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
WO-2022202985-A1 PEPTIDE AND COMPOSITION CONTAINING PEPTIDE AS ACTIVE INGREDIENT 森永乳業株式会社 2022-09-29 — — WO disclosed
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