SCHEMBL13638964

SCHEMBL13638964

CO[C@H]1CCN(c2nc(C3OC(C)O3)co2)C1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.33
USP30 Q70CQ3 1/20 0.32
MGLL Q99685 1/20 0.31
NTSR1 P30989 3/20 0.31
MAP4K4 O95819 2/20 0.30
MAP3K12 Q12852 1/20 0.30
PDE10A Q9Y233 1/20 0.30
HRH3 Q9Y5N1 1/20 0.30

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
SCHEMBL13162783 0.89
SCHEMBL13638745 0.86 PIN1 (0.30)
SCHEMBL13638796 0.83 CYP11B2 (0.32)
SCHEMBL13162781 0.83 CHRM3 (0.31)
SCHEMBL13638795 0.82 IRAK4 (0.35)
SCHEMBL13638965 0.80 PDE3B (0.45) PDE10A
SCHEMBL13638797 0.80
SCHEMBL13162801 0.79 GPR119 (0.34)
SCHEMBL13638967 0.79 GPR119 (0.40)
SCHEMBL13162326 0.78 OGA (0.34)

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
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed