SCHEMBL17059952

SCHEMBL17059952

CC(=O)c1ccc(Nc2cc3c(cn2)N(C)C(=O)c2ccccc2N3C)c(CC(C)C)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPK7 Q13164 10/20 0.51
▸ BRD4 O60885 8/20 0.51
▸ KCNH2 Q12809 1/20 0.51
▸ NR1H2 P55055 1/20 0.41
▸ NR1H3 Q13133 1/20 0.41
▸ LRRK2 Q5S007 6/20 0.38
▸ DCLK1 O15075 4/20 0.38
▸ NUAK1 O60285 2/20 0.38
▸ BRDT Q58F21 2/20 0.37
▸ PIK3CD O00329 1/20 0.36
▸ AURKA O14965 1/20 0.36
▸ PIK3C2G O75747 1/20 0.36
▸ PIK3CG P48736 1/20 0.36
▸ AURKB Q96GD4 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
SCHEMBL18369796 0.83 BRD4 (0.70) MAPK7BRD4KCNH2NR1H2NR1H3
SCHEMBL17059911 0.76 BRD4 (0.70) MAPK7BRD4KCNH2NR1H2NR1H3
SCHEMBL18369881 0.75 BRD4 (0.69) MAPK7BRD4KCNH2LRRK2DCLK1
SCHEMBL18370096 0.75 MAPK7 (0.48) MAPK7BRD4KCNH2LRRK2DCLK1
SCHEMBL18379131 0.74 BRD4 (0.68) MAPK7BRD4KCNH2LRRK2DCLK1
SCHEMBL18369886 0.74 MAPK7 (0.57) MAPK7BRD4KCNH2LRRK2DCLK1
SCHEMBL18370084 0.74 MAPK7 (0.51) MAPK7BRD4KCNH2LRRK2DCLK1
SCHEMBL18369863 0.74 MAPK7 (0.55) MAPK7BRD4KCNH2NR1H2NR1H3
SCHEMBL18370089 0.74 MAPK7 (0.61) MAPK7BRD4KCNH2LRRK2DCLK1
SCHEMBL18370088 0.74 BRD4 (0.60) MAPK7BRD4KCNH2LRRK2DCLK1

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
WO-2015129927-A1 HETEROCYCLIC COMPOUNDS KYORIN PHARMACEUTICAL CO., LTD. (JP) 2015-09-03 — — WO disclosed
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