SCHEMBL10325569

SCHEMBL10325569

CCS(=O)(=O)NC(=O)c1ccc2[nH]ncc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 3/20 0.53
WNT3A P56704 3/20 0.53
MAOB P27338 7/20 0.52
NPC1 O15118 5/20 0.51
RAB9A P51151 5/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
METTL3 Q86U44 1/20 0.50
MAOA P21397 1/20 0.49
ROCK2 O75116 2/20 0.48
ROCK1 Q13464 2/20 0.48
PRKD3 O94806 1/20 0.48
MAP4K4 O95819 1/20 0.48
RPS6KB1 P23443 1/20 0.48
CLK2 P49760 1/20 0.48
DYRK1A Q13627 1/20 0.48
PRKG1 Q13976 1/20 0.48
PRKD2 Q9BZL6 1/20 0.48
CLK4 Q9HAZ1 1/20 0.48

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
SCHEMBL19086030 0.82 MAOB (0.62) CTNNB1WNT3AMAOBNPC1RAB9A
SCHEMBL3493150 0.80 MAOB (0.59) CTNNB1WNT3AMAOBNPC1RAB9A
SCHEMBL5409154 0.80 MAOB (0.59) CTNNB1WNT3AMAOBNPC1RAB9A
SCHEMBL5404361 0.80 MAOB (0.59) CTNNB1WNT3AMAOBNPC1RAB9A
SCHEMBL4404815 0.77 CTNNB1 (0.69) CTNNB1WNT3AMAOBNPC1RAB9A
SCHEMBL5425713 0.76 MAOB (0.55) CTNNB1WNT3AMAOBNPC1RAB9A
SCHEMBL5418713 0.76 ROCK2 (0.58) CTNNB1WNT3AMAOBNPC1RAB9A
SCHEMBL27836079 0.76 MAOB (0.58) CTNNB1WNT3AMAOBNPC1RAB9A
SCHEMBL28443718 0.75 CTNNB1 (0.51) CTNNB1WNT3AMAOBNPC1RAB9A
SCHEMBL28443719 0.75 CTNNB1 (0.51) CTNNB1WNT3AMAOBNPC1RAB9A

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
WO-2012095781-A1 INDAZOLE DERIVATIVES AS SODIUM CHANNEL INHIBITORS PFIZER LIMITED (GB) 2012-07-19 WO disclosed
WO-2012095781-A1 INDAZOLE DERIVATIVES AS SODIUM CHANNEL INHIBITORS PFIZER LIMITED (GB) 2012-07-19 WO disclosed