SCHEMBL14573306

SCHEMBL14573306

CCN(CC)CCNC(=O)c1ccc(-c2cnc3c(NC)nccn23)s1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ AKT3 Q9Y243 3/20 0.44
▸ IKBKB O14920 2/20 0.43
▸ ACKR3 P25106 3/20 0.41
▸ CAMK2D Q13557 4/20 0.40
▸ FLT3 P36888 2/20 0.40
▸ TTK P33981 2/20 0.39
▸ MAPKAPK5 Q8IW41 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ KCNH2 Q12809 1/20 0.36

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
SCHEMBL14573309 0.80 MAPKAPK5 (0.50) FLT3TTKMAPKAPK5L3MBTL1
SCHEMBL5618395 0.80 FLT3 (0.49) FLT3TTKMAPKAPK5
SCHEMBL5617937 0.78 FLT3 (0.47) FLT3TTKMAPKAPK5
SCHEMBL14573304 0.75 NR4A1 (0.42) CAMK2DFLT3TTK
SCHEMBL5618766 0.73 KDM4E (0.47) FLT3TTKMAPKAPK5
SCHEMBL5618288 0.72 MAPKAPK5 (0.55) FLT3TTKMAPKAPK5
SCHEMBL5618824 0.71 FLT3 (0.53) IKBKBFLT3TTKMAPKAPK5L3MBTL1
SCHEMBL5575943 0.70 CAMK2D (0.52) IKBKBCAMK2DTTKLMNAKCNH2
SCHEMBL5618266 0.69 L3MBTL3 (0.51) IKBKBACKR3FLT3TTKMAPKAPK5
SCHEMBL5618106 0.69 TTK (0.56) FLT3TTK

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-7186832-B2 Use of 8-amino-aryl-substituted imidazopyrazines as kinase inhibitors SUGEN INC. (US) 2007-03-06 — — US disclosed
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