SCHEMBL5206466

SCHEMBL5206466

N#C[C@@H]1C[C@H](F)CN1C(=O)[C@@H]1Cc2ccccc2CN1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FAP Q12884 8/20 0.56
DPP4 P27487 15/20 0.47
DPP8 Q6V1X1 6/20 0.47
DPP9 Q86TI2 6/20 0.47
DPP7 Q9UHL4 3/20 0.47
PREP P48147 3/20 0.43

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
Hydrochloric Acid SCHEMBL5206549 0.99 FAP (0.55) FAPDPP4DPP8DPP9DPP7
Hydrochloric Acid SCHEMBL5206917 0.86 DPP4 (0.49) FAPDPP4DPP8DPP9DPP7
Hydrochloric Acid SCHEMBL5206736 0.82 DPP4 (0.68) FAPDPP4DPP8DPP9DPP7
Hydrochloric Acid SCHEMBL5205359 0.81 DPP4 (0.51) FAPDPP4DPP8DPP9DPP7
Hydrochloric Acid SCHEMBL5202175 0.79 DPP4 (0.51) FAPDPP4DPP8DPP9DPP7
SCHEMBL7995561 0.79 DPP4 (0.70) FAPDPP4DPP8PREP
SCHEMBL7995565 0.79 DPP4 (0.70) FAPDPP4DPP8PREP
Trifluoroacetic Acid SCHEMBL7992003 0.75 DPP4 (0.62) FAPDPP4DPP8DPP7PREP
SCHEMBL7183413 0.74 DPP4 (0.43) FAPDPP4DPP8PREP
SCHEMBL7183418 0.74 DPP4 (0.43) FAPDPP4DPP8PREP

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-1746086-A1 Cyanopyrrolidine derivatives TAISHO PHARMACEUTICAL CO., LTD (JP) 2007-01-24 EP disclosed