SCHEMBL29945922

SCHEMBL29945922

Fc1ccc(COn2ccc(C3CCNCC3)n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 10/20 0.48
SLC6A4 P31645 10/20 0.48
SLC6A3 Q01959 10/20 0.48
HTR1A P08908 8/20 0.48
MKNK1 Q9BUB5 1/20 0.39
MKNK2 Q9HBH9 1/20 0.39
PLAT P00750 1/20 0.37
HTR6 P50406 1/20 0.35
PIM1 P11309 1/20 0.35
PIM3 Q86V86 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL29945848 0.87 HTR6 (0.46) SLC6A2SLC6A4SLC6A3HTR1AHTR6
SCHEMBL29946087 0.85 CYP19A1 (0.39) SLC6A2SLC6A4SLC6A3PLATHTR6
SCHEMBL29946162 0.83 HTR6 (0.49) SLC6A2SLC6A4SLC6A3HTR1AMKNK1
SCHEMBL29946103 0.76 SLC6A2 (0.39) SLC6A2SLC6A4SLC6A3HTR1AHTR6
SCHEMBL29945896 0.75 HTR6 (0.37) SLC6A2SLC6A4SLC6A3HTR1AHTR6
SCHEMBL29945994 0.75 GPR119 (0.46) SMN1; SMN2
SCHEMBL18418196 0.72 MKNK1 (0.43) SLC6A2SLC6A4SLC6A3HTR1AMKNK1
Hydrochloric Acid SCHEMBL21381986 0.71 MKNK1 (0.43) SLC6A2SLC6A4SLC6A3HTR1AMKNK1
SCHEMBL29945981 0.69 HTR6 (0.41) SLC6A2SLC6A4SLC6A3HTR1AHTR6
SCHEMBL8017108 0.68 PLAT (0.38) PLAT

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