SCHEMBL6460346

SCHEMBL6460346

N[C@@H](CC(=O)N1CCCCC1)Cc1ccccc1F

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.70
DPP7 Q9UHL4 5/20 0.70
DPP8 Q6V1X1 4/20 0.60
CYP3A4 P08684 1/20 0.57
DPP9 Q86TI2 2/20 0.55

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
SCHEMBL14006817 0.99 DPP4 (0.71) DPP4DPP7DPP8CYP3A4
SCHEMBL8483179 0.87 DPP4 (0.67) DPP4DPP7DPP8CYP3A4DPP9
SCHEMBL8474386 0.86 DPP4 (0.65) DPP4DPP7DPP8CYP3A4DPP9
SCHEMBL8491036 0.84 DPP4 (0.60) DPP4DPP7DPP8CYP3A4
SCHEMBL8481902 0.84 DPP4 (0.60) DPP4DPP7DPP8DPP9
SCHEMBL8473641 0.84 DPP4 (0.64) DPP4DPP7DPP8CYP3A4DPP9
SCHEMBL8474394 0.83 DPP4 (0.61) DPP4DPP7DPP8CYP3A4DPP9
SCHEMBL8491016 0.83 DPP4 (0.61) DPP4DPP7DPP8CYP3A4DPP9
SCHEMBL4956199 0.82 DPP4 (0.58) DPP4DPP7DPP8DPP9
SCHEMBL8290155 0.82 DPP4 (0.58) DPP4DPP7DPP8DPP9

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-1541143-A1 DPP-IV INHIBITORS Graffinity Pharmaceuticals Aktiengesellschaft (DE) 2005-06-15 EP disclosed