SCHEMBL30357985

SCHEMBL30357985

[N-]=[N+]=N[C@@H](CC(=O)N1CCn2c(nnc2C(F)(F)F)C1)Cc1cc(F)c(F)cc1F

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 20/20 0.71
▸ DPP8 Q6V1X1 9/20 0.71
▸ DPP9 Q86TI2 3/20 0.71
▸ DPP7 Q9UHL4 2/20 0.71
▸ ACE P12821 1/20 0.71
▸ HTR2A P28223 1/20 0.71
▸ FAP Q12884 1/20 0.71

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
SCHEMBL15346016 1.00 DPP4 (0.71) DPP4DPP8DPP9DPP7ACE
SCHEMBL15346060 1.00 DPP4 (0.71) DPP4DPP8DPP9DPP7ACE
SCHEMBL15346013 1.00 DPP4 (0.71) DPP4DPP8DPP9DPP7ACE
SCHEMBL15362764 0.87 DPP4 (0.58) DPP4DPP8DPP9DPP7ACE
SCHEMBL15362762 0.87 DPP4 (0.58) DPP4DPP8DPP9DPP7ACE
SCHEMBL10025044 0.86 DPP4 (0.72) DPP4DPP8DPP9DPP7ACE
SCHEMBL15108797 0.86 DPP4 (0.75) DPP4DPP8DPP9DPP7ACE
SCHEMBL15367706 0.86 DPP4 (0.61) DPP4DPP8DPP9DPP7ACE
SCHEMBL15367713 0.86 DPP4 (0.61) DPP4DPP8DPP9DPP7ACE
SCHEMBL1288978 0.84 DPP4 (0.80) DPP4DPP8DPP9DPP7ACE

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
CN-110590485-B FSO 2 N 3 Use in the production of azido compounds 中宏鑫投资控股(深圳)有限公司 2023-04-14 — — CN disclosed
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