SCHEMBL8365644

SCHEMBL8365644

CNC(=O)c1ccc2[nH]nc(-c3ccc(N(C)C)cc3)c2c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.53
MAPK1 P28482 13/20 0.51
MAP2K4 P45985 3/20 0.51
MAPKAPK3 Q16644 3/20 0.51
MAPK6 Q16659 3/20 0.51
CSNK1D P48730 1/20 0.51
MAPKAPK2 P49137 1/20 0.50
MAPKAPK5 Q8IW41 1/20 0.50
MAP2K7 O14733 1/20 0.50
ROCK2 O75116 1/20 0.50
ROCK1 Q13464 1/20 0.50
ABL1 P00519 1/20 0.49
BCR P11274 1/20 0.49
MAPK3 P27361 6/20 0.48
TTK P33981 1/20 0.47
MAP4K1 Q92918 1/20 0.45

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
SCHEMBL5377406 0.85 MAP2K4 (0.66) FLT3MAPK1MAP2K4MAPKAPK3MAPK6
SCHEMBL8251977 0.85 MAP2K4 (0.55) MAPK1MAP2K4MAPKAPK3MAPK6CSNK1D
SCHEMBL12073055 0.75 CSNK1D (0.51) MAPK1MAP2K4MAPKAPK3MAPK6CSNK1D
SCHEMBL5379122 0.74 LRRK2 (0.54) FLT3MAPK1MAP2K4MAPKAPK3MAPK6
SCHEMBL2861089 0.74 ROCK2 (0.54) MAPK1MAP2K4MAPKAPK3MAPK6ROCK2
SCHEMBL5377540 0.73 MAPK1 (0.54) MAPK1MAP2K4MAPKAPK3MAPK6MAPKAPK2
SCHEMBL2567664 0.72 GAA (0.66)
SCHEMBL19965569 0.72 MAP2K4 (0.47) FLT3MAPK1MAP2K4MAPKAPK3MAPK6
SCHEMBL6320721 0.72 MAPK1 (0.60) FLT3MAPK1CSNK1DABL1BCR
SCHEMBL30147526 0.72 CCNC (0.50) FLT3CSNK1DTTK

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-2002010137-A9 INDAZOLE DERIVATIVES AS JNK INHIBITORS SIGNAL PHARM INC (US) 2003-02-06 WO disclosed