SCHEMBL11055026

SCHEMBL11055026

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

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 16/20 0.53
▸ DPP4 P27487 1/20 0.49
▸ DPP8 Q6V1X1 1/20 0.49
▸ DPP9 Q86TI2 1/20 0.49
▸ CTSD P07339 3/20 0.49
▸ ECE1 P42892 2/20 0.47
▸ ALOX15 P16050 1/20 0.42
▸ BLM P54132 1/20 0.42
▸ PMP22 Q01453 1/20 0.42
▸ KMT2A Q03164 1/20 0.42

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
SCHEMBL11055014 0.94 BACE1 (0.59) BACE1DPP4DPP8DPP9CTSD
SCHEMBL30591036 0.93 DPP4 (0.52) BACE1DPP4DPP8DPP9CTSD
SCHEMBL29777801 0.91 DPP4 (0.52) BACE1DPP4DPP8DPP9CTSD
SCHEMBL30525295 0.90 DPP4 (0.55) BACE1DPP4DPP8DPP9CTSD
SCHEMBL30011133 0.90 ALOX15 (0.49) BACE1DPP4DPP8DPP9CTSD
SCHEMBL29725305 0.90 DPP4 (0.49) BACE1DPP4DPP8DPP9CTSD
SCHEMBL31571448 0.89 BACE1 (0.55) BACE1DPP4DPP8DPP9CTSD
SCHEMBL30590515 0.88 BACE1 (0.55) BACE1CTSDECE1
SCHEMBL11050000 0.88 BACE1 (0.54) BACE1CTSDECE1
SCHEMBL31571449 0.88 BACE1 (0.58) BACE1DPP4DPP8DPP9CTSD

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
US-4426324-A Immunopotentiating peptides HOFFMANN-LA ROCHE INC. (US) 1984-01-17 — — US disclosed
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