SCHEMBL17152254

SCHEMBL17152254

CO[C@H]1CCCN(C(=O)[CH]CC(C)C(N)=O)C1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.38
DPP7 Q9UHL4 1/20 0.38
ENPP2 Q13822 3/20 0.34
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
VNN1 O95497 1/20 0.32
ALDH1A1 P00352 2/20 0.32
POLB P06746 1/20 0.32
PARP14 Q460N5 1/20 0.31
PSMB8 P28062 2/20 0.31
PSMB5 P28074 2/20 0.31
MAPK1 P28482 1/20 0.31
OPRK1 P41145 1/20 0.31
PSMA1 P25786 1/20 0.31
PSMB9 P28065 1/20 0.31
PSMB4 P28070 1/20 0.31
PSMB10 P40306 1/20 0.31
GRM5 P41594 1/20 0.31

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
SCHEMBL17152625 0.84 HRH3 (0.33) DPP4DPP7NPC1RAB9AALDH1A1
SCHEMBL17152504 0.84 ENPP2 (0.36) ENPP2NPC1RAB9AVNN1ALDH1A1
SCHEMBL6053655 0.79 ALDH1A1 (0.36) DPP7NPC1RAB9AALDH1A1POLB
SCHEMBL17152479 0.77 DPP4 (0.47) DPP4DPP7OPRK1
SCHEMBL17152249 0.76 KDM1A (0.37)
SCHEMBL17152435 0.76 KDM1A (0.37)
SCHEMBL17152366 0.75 BTK (0.34) POLBOPRK1
SCHEMBL17152542 0.74 L3MBTL3 (0.40)
SCHEMBL17152156 0.74 DPP4 (0.39) DPP4ENPP2RAB9APOLB
SCHEMBL17152622 0.74 DPP4 (0.39) DPP4ENPP2RAB9APOLB

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-2897939-B1 BENZOIMIDAZOLE-CARBOXYLIC ACID AMIDE DERIVATIVES FOR TREATING METABOLIC OR CARDIOVASCULAR DISEASES SANOFI SA (FR) 2017-02-01 EP disclosed
US-9156796-B2 Benzoimidazole-carboxylic acid amide derivatives as APJ receptor modulators SANOFI (FR) 2015-10-13 US disclosed