SCHEMBL29945948

SCHEMBL29945948

CC(C)(C)OC(=O)n1ccc(OCc2ccc(F)cc2F)n1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.45
PTGER1 P34995 3/20 0.43
GPR119 Q8TDV5 2/20 0.40
GSK3B P49841 2/20 0.40
BACE1 P56817 2/20 0.40
KDM5A P29375 1/20 0.40
KDM4C Q9H3R0 1/20 0.40
KDM5B Q9UGL1 1/20 0.40
ALKBH1 Q13686 1/20 0.40
HTR2C P28335 3/20 0.38
SLC6A4 P31645 3/20 0.38
HTR2A P28223 2/20 0.38
IDO1 P14902 2/20 0.38
AGXT P21549 2/20 0.38
MAPK14 Q16539 2/20 0.37
RIPK1 Q13546 2/20 0.37

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
SCHEMBL29945979 0.89 KDM5A (0.41) PTGER1GPR119KDM5AKDM5BHTR2C
SCHEMBL29573851 0.86 GPR119 (0.42) GPR119
SCHEMBL24265933 0.86 GPR119 (0.42) GPR119
SCHEMBL29946041 0.81 GPR119 (0.45) GPR119
SCHEMBL21438728 0.77 BCHE (0.33) GPR119
SCHEMBL20029774 0.77 GPR119 (0.39) GPR119
SCHEMBL24265552 0.77 PKM (0.47) MAOBPTGER1GPR119ALKBH1
SCHEMBL6501537 0.76 MAPK14 (0.58) MAPK14
SCHEMBL4786618 0.76 NR1H2 (0.33) GPR119
SCHEMBL20253390 0.76 NUDT1 (0.36) GPR119

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
WO-2022184849-A1 GLP-1R AGONISTS, USES AND PHARMACEUTICAL COMPOSITIONS THEREOF LES LABORATOIRES SERVIER (FR) 2022-09-09 WO disclosed