SCHEMBL6692641

SCHEMBL6692641

N#C[C@@H]1CCCN1C(=O)CC(N)CCc1cccc2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 11/20 0.63
PREP P48147 9/20 0.61
FAP Q12884 5/20 0.55
DPP8 Q6V1X1 10/20 0.49
DPP9 Q86TI2 6/20 0.49
DPP7 Q9UHL4 4/20 0.47

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
SCHEMBL6684487 1.00 DPP4 (0.63) DPP4PREPFAPDPP8DPP9
SCHEMBL6693335 0.90 DPP4 (0.65) DPP4PREPFAPDPP8DPP9
SCHEMBL6688053 0.86 DPP4 (0.64) DPP4PREPFAPDPP8DPP9
SCHEMBL6692186 0.85 DPP4 (0.62) DPP4PREPFAPDPP8DPP9
SCHEMBL6686205 0.85 DPP4 (0.62) DPP4PREPFAPDPP8DPP9
SCHEMBL6686177 0.80 DPP4 (0.55) DPP4PREPFAPDPP8DPP7
SCHEMBL6688921 0.79 DPP4 (0.63) DPP4PREPFAPDPP8DPP9
SCHEMBL6685461 0.78 PREP (0.58) DPP4PREPFAPDPP8DPP9
SCHEMBL5228430 0.77 DPP4 (0.73) DPP4FAPDPP8DPP9DPP7
SCHEMBL6687255 0.77 DPP4 (0.66) DPP4PREPFAPDPP8DPP9

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-2004089362-A1 2-CYANOPYRROLES AND THEIR ANALOGUES AS DDP-IV INHIBITORS NOVO NORDISK A/S (DK) 2004-10-21 WO disclosed