SCHEMBL29382397

SCHEMBL29382397

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

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 11/20 0.54
▸ FOLH1 Q04609 3/20 0.49
▸ DPP4 P27487 3/20 0.49
▸ DPP8 Q6V1X1 3/20 0.49
▸ DPP9 Q86TI2 3/20 0.49
▸ DPP7 Q9UHL4 3/20 0.49
▸ RIMKLA Q8IXN7 1/20 0.47
▸ NAALAD2 Q9Y3Q0 1/20 0.47
▸ GNPAT O15228 1/20 0.47
▸ SLC15A1 P46059 1/20 0.45

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
SCHEMBL29684179 0.99 NOD1 (0.52) NOD1FOLH1DPP4DPP8DPP9
SCHEMBL31674332 0.97 NOD1 (0.52) NOD1FOLH1DPP4DPP8DPP9
SCHEMBL29376967 0.96 NOD1 (0.53) NOD1FOLH1DPP4DPP8DPP9
SCHEMBL29382412 0.96 NOD1 (0.55) NOD1FOLH1DPP4DPP8DPP9
SCHEMBL30101988 0.94 FOLH1 (0.60) NOD1FOLH1DPP4DPP8DPP9
SCHEMBL31256792 0.94 FOLH1 (0.60) NOD1FOLH1DPP4DPP8DPP9
SCHEMBL29371375 0.93 NOD1 (0.56) NOD1FOLH1DPP4DPP8DPP9
SCHEMBL29843198 0.93 NOD1 (0.56) NOD1FOLH1DPP4DPP8DPP9
SCHEMBL30555003 0.93 DPP7 (0.55) NOD1DPP4DPP8DPP9DPP7
SCHEMBL32687011 0.91 FOLH1 (0.54) NOD1FOLH1DPP4DPP8DPP9

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-116171282-A Soluble NPY2 receptor agonists 勃林格殷格翰国际有限公司 2023-05-26 — — CN disclosed
Send feedback