SCHEMBL5318247

SCHEMBL5318247

c1cncc(-c2cnc(Nc3ccc4[nH]ncc4c3)o2)c1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 3/20 0.57
PIM1 P11309 1/20 0.49
PIM3 Q86V86 1/20 0.49
PIM2 Q9P1W9 1/20 0.49
ROCK2 O75116 2/20 0.47
ROCK1 Q13464 1/20 0.47
MAPKAPK2 P49137 1/20 0.46
FGFR1 P11362 1/20 0.45
KIT P10721 1/20 0.45
KDR P35968 7/20 0.45
FLT1 P17948 3/20 0.45
FLT4 P35916 3/20 0.45
CDC7 O00311 1/20 0.45
MKNK1 Q9BUB5 1/20 0.44
VCP P55072 1/20 0.43
PIK3CA P42336 1/20 0.42

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
SCHEMBL5338255 0.91 IMPDH2 (0.57) IMPDH2PIM1PIM3PIM2FGFR1
SCHEMBL14465941 0.88 IMPDH2 (0.61) IMPDH2ROCK1KDRFLT1FLT4
SCHEMBL5336680 0.86 IMPDH2 (0.59) IMPDH2ROCK1KDRFLT1FLT4
SCHEMBL5337614 0.83 PIK3CA (0.54) IMPDH2ROCK2ROCK1KDRFLT1
SCHEMBL5317045 0.83 VCP (0.63) IMPDH2ROCK2ROCK1KDRFLT1
SCHEMBL5319685 0.82 IMPDH2 (0.54) IMPDH2ROCK2ROCK1MAPKAPK2FGFR1
SCHEMBL5335613 0.81 CDC7 (0.58) IMPDH2ROCK2ROCK1MAPKAPK2KDR
SCHEMBL5336433 0.81 MKNK1 (0.51) IMPDH2ROCK2ROCK1MAPKAPK2KDR
SCHEMBL5333205 0.81 IMPDH2 (0.53) IMPDH2ROCK2ROCK1MAPKAPK2KDR
SCHEMBL5316809 0.81 NOS1 (0.48) IMPDH2ROCK2ROCK1MAPKAPK2KDR

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-2007076161-A2 COMPOUNDS WITH THERAPEUTIC ACTIVITY MYRIAD GENETICS, INC (US) 2007-07-05 WO claimed
WO-2007076161-A2 COMPOUNDS WITH THERAPEUTIC ACTIVITY MYRIAD GENETICS, INC (US) 2007-07-05 WO disclosed