SCHEMBL6238524

SCHEMBL6238524

CC[C@H](C)[C@H](N)C(=O)N1CCCC1C#N

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 19/20 1.00
DPP8 Q6V1X1 3/20 0.61
DPP9 Q86TI2 3/20 0.61
FAP Q12884 2/20 0.61
DPP7 Q9UHL4 2/20 0.61

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
SCHEMBL6238520 1.00 DPP4 (1.00) DPP4DPP8DPP9FAPDPP7
SCHEMBL5647937 1.00 DPP4 (1.00) DPP4DPP8DPP9FAPDPP7
SCHEMBL5647935 1.00 DPP4 (1.00) DPP4DPP8DPP9FAPDPP7
Hydrochloric Acid SCHEMBL3601691 0.99 DPP4 (0.97) DPP4DPP8DPP9FAPDPP7
Hydrochloric Acid SCHEMBL5652236 0.99 DPP4 (0.97) DPP4DPP8DPP9FAPDPP7
Hydrochloric Acid SCHEMBL5049190 0.99 DPP4 (0.97) DPP4DPP8DPP9FAPDPP7
Hydrochloric Acid SCHEMBL5652234 0.99 DPP4 (0.97) DPP4DPP8DPP9FAPDPP7
Trifluoroacetic Acid SCHEMBL5203128 0.92 DPP4 (0.84) DPP4DPP8
Trifluoroacetic Acid SCHEMBL5203132 0.92 DPP4 (0.84) DPP4DPP8
Trifluoroacetic Acid SCHEMBL5696185 0.92 DPP4 (0.84) DPP4DPP8

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
EP-1171121-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING DIPEPTIDYLPEPTIDASE IV INHIBITORS FOR THE PROMOTION OF GROWTH FERRING BV (NL) 2005-06-15 EP disclosed