SCHEMBL458365

SCHEMBL458365

Cc1csc(N2CCC(CO)CC2)n1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.48
DPP4 P27487 1/20 0.42
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
PDE10A Q9Y233 1/20 0.39
CHRM3 P20309 1/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
OGA O60502 2/20 0.38
MEN1 O00255 1/20 0.38
MAP2K7 O14733 1/20 0.36
PIK3CA P42336 1/20 0.36
MTOR P42345 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
SCHEMBL10136842 0.80 HRH3 (0.49) HRH3DPP4LMNAL3MBTL1SMN1; SMN2
SCHEMBL2056291 0.79 TSHR (0.51) LMNAL3MBTL1SMN1; SMN2NPC1CHRM3
SCHEMBL3435164 0.77 OGA (0.50) HRH3LMNAL3MBTL1SMN1; SMN2NPC1
SCHEMBL3549078 0.76 SMN1; SMN2 (0.36) HRH3LMNAL3MBTL1SMN1; SMN2NPC1
SCHEMBL13634230 0.76 HRH3 (0.55) HRH3DPP4LMNAL3MBTL1SMN1; SMN2
SCHEMBL12988798 0.76 HRH3 (0.52) HRH3DPP4LMNAL3MBTL1SMN1; SMN2
SCHEMBL3559247 0.76 HRH3 (0.55) HRH3DPP4LMNAL3MBTL1SMN1; SMN2
SCHEMBL29225087 0.76 HRH3 (0.46) HRH3DPP4LMNAL3MBTL1SMN1; SMN2
SCHEMBL13634364 0.76 HRH3 (0.46) HRH3DPP4LMNAL3MBTL1SMN1; SMN2
SCHEMBL13634292 0.76 HRH3 (0.52) HRH3DPP4LMNAL3MBTL1SMN1; SMN2

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-2011147951-A1 CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS PROSIDION LIMITED (GB) 2011-12-01 WO disclosed