SCHEMBL14548972

SCHEMBL14548972

O=C([C@H]1CCCN1)N1CCCCC1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 10/20 0.62
DPP8 Q6V1X1 4/20 0.62
DPP9 Q86TI2 4/20 0.62
HPGD P15428 1/20 0.52
FAP Q12884 1/20 0.51
DPP7 Q9UHL4 1/20 0.51
PARP1 P09874 1/20 0.43
HRH2 P25021 1/20 0.42
HRH1 P35367 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
TGM2 P21980 1/20 0.41
NOS2 P35228 2/20 0.41
CA2 P00918 1/20 0.41
CHKA P35790 1/20 0.41
NOS3 P29474 1/20 0.41
NOS1 P29475 1/20 0.41

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
SCHEMBL3331450 1.00 DPP4 (0.62) DPP4DPP8DPP9HPGDFAP
SCHEMBL3335449 1.00 DPP4 (0.62) DPP4DPP8DPP9HPGDFAP
SCHEMBL10326191 1.00 DPP4 (0.62) DPP4DPP8DPP9HPGDFAP
SCHEMBL1383434 0.98 DPP4 (0.64) DPP4DPP8DPP9HPGDFAP
SCHEMBL488954 0.98 DPP4 (0.64) DPP4DPP8DPP9HPGDFAP
SCHEMBL488953 0.98 DPP4 (0.64) DPP4DPP8DPP9HPGDFAP
Hydrochloric Acid SCHEMBL5413834 0.96 DPP4 (0.62) DPP4DPP8DPP9HPGDFAP
SCHEMBL13661462 0.94 DPP4 (0.56) DPP4DPP8DPP9HPGDFAP
SCHEMBL1871830 0.94 DPP4 (0.56) DPP4DPP8DPP9HPGDFAP
SCHEMBL3332858 0.94 DPP4 (0.64) DPP4DPP8DPP9HPGDFAP

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2438989-B1 USE OF ASYMMETRIC HYDROGENATION CATALYST TAKASAGO PERFUMERY CO LTD (JP) 2016-04-13 EP disclosed
EP-2543437-A2 HOMOGENEOUS ASYMMETRIC HYDROGENATION CATALYST Takasago International Corporation (JP) 2013-01-09 EP disclosed