SCHEMBL29399779

SCHEMBL29399779

COC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DPP8 Q6V1X1 6/20 0.51
▸ DPP9 Q86TI2 6/20 0.51
▸ DPP7 Q9UHL4 5/20 0.51
▸ GNAI3 P08754 1/20 0.48
▸ GNAO1 P09471 1/20 0.48
▸ GNAI1 P63096 1/20 0.48
▸ GSR P00390 1/20 0.46
▸ BIRC2 Q13490 1/20 0.46
▸ DPP4 P27487 3/20 0.46
▸ ERAP2 Q6P179 5/20 0.43
▸ LNPEP Q9UIQ6 2/20 0.43
▸ ERAP1 Q9NZ08 2/20 0.42
▸ TLR2 O60603 2/20 0.40
▸ SLC15A1 P46059 1/20 0.39
▸ MMP2 P08253 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
SCHEMBL13079191 1.00 DPP8 (0.51) DPP8DPP9DPP7GNAI3GNAO1
SCHEMBL27405538 0.87 BIRC2 (0.44) DPP8DPP9DPP7BIRC2DPP4
SCHEMBL27405539 0.87 BIRC2 (0.44) DPP8DPP9DPP7BIRC2DPP4
Hydrochloric Acid SCHEMBL15512436 0.86 DPP8 (0.51) DPP8DPP9DPP7GNAI3GNAO1
SCHEMBL30064530 0.85 DPP8 (0.47) DPP8DPP9DPP7GNAI3GNAO1
SCHEMBL13496274 0.84 ERAP2 (0.54) DPP8DPP9DPP7GNAI3GNAO1
SCHEMBL19376936 0.83 GSR (0.58) DPP8DPP9DPP7GNAI3GNAO1
SCHEMBL2115368 0.83 GSR (0.58) DPP8DPP9DPP7GNAI3GNAO1
SCHEMBL17510190 0.83 GSR (0.58) DPP8DPP9DPP7GNAI3GNAO1
SCHEMBL7781619 0.83 GSR (0.58) DPP8DPP9DPP7GNAI3GNAO1

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-112851536-B Method for constructing amide bond by clicking pyrimidine condensing agent and application of method in amide and polypeptide synthesis 兰州大学 2022-02-25 — — CN disclosed
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