SCHEMBL13634688

SCHEMBL13634688

COCCN(C)c1nc(C(=O)Nc2ccc(C(=O)N3CCN(C)CC3)cc2OC)cs1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAP3K7 O43318 8/20 0.53
IRAK4 Q9NWZ3 2/20 0.45
DYRK1A Q13627 3/20 0.44
LRRK2 Q5S007 2/20 0.43
ALK Q9UM73 1/20 0.41
TTK P33981 2/20 0.41
ADORA2A P29274 1/20 0.41
ADORA2B P29275 1/20 0.41
ADORA1 P30542 1/20 0.41
NUAK1 O60285 1/20 0.40

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
SCHEMBL13634845 0.85 PYGL (0.42) IRAK4LRRK2
SCHEMBL13634600 0.85 IRAK4 (0.42) IRAK4LRRK2
SCHEMBL13634648 0.73 MAP3K7 (0.51) MAP3K7IRAK4LRRK2ALKTTK
SCHEMBL13634763 0.70 F10 (0.38) IRAK4
SCHEMBL13270429 0.70 IRAK4 (0.38) MAP3K7IRAK4
SCHEMBL2774000 0.70 POLB (0.49)
SCHEMBL13163173 0.69 GRM2 (0.37)
SCHEMBL13634893 0.69 ADORA2A (0.38) ADORA2AADORA1
SCHEMBL13270438 0.69 ADORA2A (0.38) ADORA2AADORA2BADORA1
SCHEMBL6975265 0.68 LMNA (0.62) ADORA2AADORA2BADORA1

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