SCHEMBL13634185

SCHEMBL13634185

CO[C@H]1CCN(c2nc(C)cs2)C1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 7/20 0.50
L3MBTL1 Q9Y468 1/20 0.40
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
DPP4 P27487 1/20 0.36
CHRM3 P20309 1/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
MAPT P10636 1/20 0.36
OGA O60502 2/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
PDE10A Q9Y233 1/20 0.35
PIN1 Q13526 1/20 0.35

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
SCHEMBL10278217 0.91 HRH3 (0.48) HRH3L3MBTL1RAB9ANPC1ALDH1A1
SCHEMBL3559247 0.91 HRH3 (0.55) HRH3L3MBTL1RAB9ANPC1SMN1; SMN2
SCHEMBL13634365 0.84 HRH3 (0.47) HRH3L3MBTL1RAB9ANPC1ALDH1A1
SCHEMBL13634230 0.81 HRH3 (0.55) HRH3L3MBTL1RAB9ANPC1SMN1; SMN2
SCHEMBL13634265 0.81 HRH3 (0.42) HRH3RAB9ANPC1ALDH1A1MAPT
SCHEMBL3555940 0.80 HRH3 (0.44) HRH3L3MBTL1RAB9ANPC1ALDH1A1
SCHEMBL13162579 0.79 HRH3 (0.47) HRH3RAB9ANPC1ALDH1A1SMN1; SMN2
SCHEMBL13634311 0.79 HRH3 (0.47) HRH3RAB9ANPC1ALDH1A1SMN1; SMN2
SCHEMBL13634364 0.78 HRH3 (0.46) HRH3L3MBTL1RAB9ANPC1ALDH1A1
SCHEMBL29225087 0.78 HRH3 (0.46) HRH3L3MBTL1RAB9ANPC1ALDH1A1

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