SCHEMBL13634211

SCHEMBL13634211

CCc1coc(N2CC[C@@H](F)C2)n1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 3/20 0.39
HRH3 Q9Y5N1 2/20 0.34
CHRM3 P20309 2/20 0.33
PDE4A P27815 2/20 0.33
PDE4B Q07343 2/20 0.33
PDE4C Q08493 2/20 0.33
PDE4D Q08499 2/20 0.33
LRRK2 Q5S007 1/20 0.31
HTR3A P46098 1/20 0.31
KCNH2 Q12809 1/20 0.31
CHRM4 P08173 1/20 0.31
PDE10A Q9Y233 2/20 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
SCHEMBL13634304 0.91 HRH4 (0.38) HRH4HRH3HTR3AKCNH2
SCHEMBL13634262 0.85 HRH4 (0.35) HRH4HRH3LRRK2
SCHEMBL13634313 0.84 CNR2 (0.37) HRH4HRH3PDE10A
SCHEMBL13634239 0.81 AOC3 (0.35) HRH4HRH3CHRM3PDE4APDE4B
SCHEMBL13634240 0.80 HRH4 (0.33) HRH4HRH3
SCHEMBL13634305 0.80 GPR119 (0.43) HRH4HRH3HTR3AKCNH2
SCHEMBL13634210 0.76 HRH3 (0.33) HRH4HRH3
SCHEMBL13634325 0.75 ACACB (0.35)
SCHEMBL13612636 0.74 HTR6 (0.44) HRH4HTR3A
SCHEMBL13634370 0.74 MAPK1 (0.39) KCNH2

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