SCHEMBL13634268

SCHEMBL13634268

CCc1csc(N2CCC[C@H](OC)C2)n1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.45
MAP4K4 O95819 1/20 0.40
CTSB P07858 1/20 0.38
CTSS P25774 1/20 0.38
CTSK P43235 1/20 0.38
DGAT2 Q96PD7 1/20 0.37
OGA O60502 1/20 0.37
PIN1 Q13526 3/20 0.37
DNM1L O00429 5/20 0.36
CHRM3 P20309 1/20 0.35
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
LMNA P02545 1/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
RAB9A P51151 1/20 0.34
POLB P06746 1/20 0.33

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
SCHEMBL13634265 0.92 HRH3 (0.42) HRH3CTSBCTSSCTSKOGA
SCHEMBL13634205 0.86 OGA (0.39) HRH3CTSBCTSSCTSKDGAT2
SCHEMBL13634266 0.83 HRH3 (0.46) HRH3MAP4K4CTSBCTSSCTSK
SCHEMBL10278217 0.82 HRH3 (0.48) HRH3MAP4K4DGAT2OGAPIN1
SCHEMBL13634188 0.81 DNM1L (0.49) HRH3CTSBCTSSCTSKDGAT2
SCHEMBL10279631 0.78 OGA (0.48) CTSBCTSSCTSKOGADNM1L
SCHEMBL3436064 0.77 HRH3 (0.40) HRH3MAP4K4DGAT2PIN1DNM1L
SCHEMBL13999803 0.77 ALDH1A1 (0.47) HRH3OGALMNANPC1ALDH1A1
SCHEMBL3554282 0.77 HRH3 (0.44) HRH3MAP4K4OGAPIN1LMNA
SCHEMBL13634334 0.76 DNM1L (0.42) HRH3CTSBCTSSCTSKOGA

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