SCHEMBL13295506

SCHEMBL13295506

CB(O)[C@H](C)NC(=O)[C@@H](N)C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 15/20 0.41
▸ DPP8 Q6V1X1 4/20 0.40
▸ DPP9 Q86TI2 4/20 0.40
▸ DPP7 Q9UHL4 4/20 0.40
▸ FAP Q12884 2/20 0.40
▸ GLS O94925 1/20 0.39
▸ CA12 O43570 2/20 0.38
▸ CA1 P00915 2/20 0.38
▸ CA2 P00918 2/20 0.38
▸ MMP2 P08253 2/20 0.38
▸ CA9 Q16790 2/20 0.38

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
SCHEMBL17814216 0.89 DPP4 (0.55) DPP4DPP8DPP9DPP7FAP
SCHEMBL15087472 0.75 DPP4 (0.41) DPP4DPP7GLSCA12CA1
SCHEMBL10213727 0.75 DPP4 (0.37) DPP4DPP7GLSCA12CA1
SCHEMBL13259713 0.75 DPP4 (0.40) DPP4DPP8DPP9DPP7FAP
SCHEMBL15386492 0.75 DPP4 (0.41) DPP4DPP8DPP9DPP7FAP
SCHEMBL13285826 0.75 DPP4 (0.41) DPP4DPP8DPP9DPP7FAP
SCHEMBL29886476 0.74 ALDH1A1 (0.55) DPP4DPP7GLSCA12CA1
SCHEMBL13201866 0.73 GLS (0.40) DPP4DPP8DPP9DPP7FAP
SCHEMBL14097634 0.73 DPP4 (0.46) DPP4DPP8DPP9DPP7FAP
SCHEMBL1174761 0.73 DPP4 (0.46) DPP4DPP8DPP9DPP7FAP

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-7727964-B2 Peptidomimetic inhibitors of post-proline cleaving enzymes TRUSTEES OF TUFTS COLLEGE (US) 2010-06-01 — — US disclosed
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