SCHEMBL13638965

SCHEMBL13638965

CC1OC(c2coc(N3CC[C@H](Oc4ccccn4)C3)n2)O1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 3/20 0.45
PDE3A Q14432 3/20 0.45
PDE10A Q9Y233 3/20 0.45
RET P07949 3/20 0.39
ACACB O00763 1/20 0.37
KDM5A P29375 1/20 0.37
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
RIPK1 Q13546 1/20 0.35
SCN9A Q15858 1/20 0.35
CYP11B2 P19099 1/20 0.34
EPHX2 P34913 1/20 0.34

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
SCHEMBL13162802 0.94 RET (0.41) PDE3BPDE3APDE10ARETACACB
SCHEMBL13638796 0.87 CYP11B2 (0.32) ACACBCYP11B2
SCHEMBL13162326 0.81 OGA (0.34) EPHX2
SCHEMBL13638964 0.80 AOC3 (0.33) PDE10A
SCHEMBL13634302 0.80 PDE3B (0.47) PDE3BPDE3APDE10ARETACACB
SCHEMBL13162320 0.80 NAAA (0.43) RETEPHX2
SCHEMBL13162784 0.78
SCHEMBL13638745 0.77 PIN1 (0.30)
SCHEMBL13634347 0.77 KDM5A (0.44) PDE3BPDE3APDE10ARETACACB
SCHEMBL13162794 0.76 CHRM4 (0.30)

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