SCHEMBL29946002

SCHEMBL29946002

Fc1ccc(COc2ccn(C3CCNCC3)n2)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.49
ALK Q9UM73 2/20 0.44
SLC6A4 P31645 6/20 0.41
HTR2A P28223 2/20 0.41
HTR2C P28335 2/20 0.41
MAP4K3 Q8IVH8 3/20 0.39
SLC6A2 P23975 4/20 0.39
SLC6A3 Q01959 4/20 0.39
HTR1A P08908 2/20 0.39
IDO1 P14902 2/20 0.38
AGXT P21549 2/20 0.38
MCHR1 Q99705 2/20 0.37
MET P08581 1/20 0.37
JAK2 O60674 1/20 0.37
INSR P06213 1/20 0.37
NPM1 P06748 1/20 0.37
INPPL1 O15357 1/20 0.36
SIGMAR1 Q99720 1/20 0.36

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
SCHEMBL29945894 0.89 INPPL1 (0.46) HTR6ALKSLC6A4HTR2AHTR2C
SCHEMBL29945912 0.87 KDM1A (0.39) HTR6ALKSLC6A4MAP4K3SLC6A2
SCHEMBL29946041 0.79 GPR119 (0.45)
SCHEMBL29946008 0.76 INPPL1 (0.43) ALKSLC6A4MAP4K3SLC6A2SLC6A3
SCHEMBL24265554 0.75 MAP4K3 (0.48) SLC6A4HTR2CMAP4K3SLC6A2SLC6A3
SCHEMBL29946021 0.75 INPPL1 (0.43) MAP4K3INPPL1SIGMAR1
SCHEMBL14635365 0.74 SIGMAR1 (0.43) ALKHTR2AHTR2CINSRNPM1
SCHEMBL29946073 0.74 MAP4K3 (0.49) HTR6SLC6A4MAP4K3SLC6A2SLC6A3
SCHEMBL29945931 0.73 MAP4K3 (0.50) HTR6SLC6A4HTR2CMAP4K3SLC6A2
SCHEMBL24485665 0.72 HTR6 (0.54) HTR6SLC6A4SLC6A2SLC6A3HTR1A

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