SCHEMBL1508959

SCHEMBL1508959

C[C@H]1CN(C(=O)C(F)(F)F)C2(CC2)CN1C(=O)[C@@H]1CCCN1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 10/20 0.38
DPP8 Q6V1X1 5/20 0.38
DPP9 Q86TI2 4/20 0.38
DPP7 Q9UHL4 2/20 0.37
FAP Q12884 1/20 0.37
HTR2C P28335 1/20 0.33
HSD11B1 P28845 1/20 0.33
ARG1 P05089 2/20 0.31
ARG2 P78540 1/20 0.31
GAA P10253 1/20 0.30

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
SCHEMBL1508726 1.00 DPP4 (0.38) DPP4DPP8DPP9DPP7FAP
SCHEMBL23340946 0.85 DPP4 (0.36) DPP4DPP8DPP9DPP7FAP
SCHEMBL1508935 0.85 DPP4 (0.36) DPP4DPP8DPP9DPP7FAP
SCHEMBL1508626 0.85 DPP4 (0.36) DPP4DPP8DPP9DPP7FAP
SCHEMBL1508930 0.82 DPP4 (0.38) DPP4
SCHEMBL1508907 0.82 DPP4 (0.38) DPP4
SCHEMBL1508928 0.82 DPP4 (0.38) DPP4
SCHEMBL1508911 0.82 DPP4 (0.38) DPP4
SCHEMBL2492932 0.81 CTSC (0.35)
SCHEMBL2490743 0.81 CTSC (0.35)

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-2298778-A1 IMIDAZOTHIAZOLE DERIVATIVE HAVING 4,7-DIAZASPIROÝ2.5¨OCTANE RING STRUCTURE Daiichi Sankyo Company, Limited (JP) 2011-03-23 EP disclosed