SCHEMBL7366347

SCHEMBL7366347

O=c1[nH]nc(-c2cccc(Br)c2)c2ncccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 5/20 0.46
NPSR1 Q6W5P4 2/20 0.45
ATM Q13315 1/20 0.45
DCLK1 O15075 1/20 0.44
PRKD3 O94806 1/20 0.44
MAP4K4 O95819 1/20 0.44
CHEK2 O96017 1/20 0.44
CSF1R P07333 1/20 0.44
FER P16591 1/20 0.44
CDK2 P24941 1/20 0.44
MARK3 P27448 1/20 0.44
FLT4 P35916 1/20 0.44
FLT3 P36888 1/20 0.44
MAPK9 P45984 1/20 0.44
CSNK1D P48730 1/20 0.44
CLK2 P49760 1/20 0.44
CSNK2A1 P68400 1/20 0.44
CSNK1G2 P78368 1/20 0.44
MAP4K2 Q12851 1/20 0.44
STK3 Q13188 1/20 0.44

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
SCHEMBL7363947 0.90 DCLK1 (0.46) PARP1NPSR1ATMDCLK1PRKD3
SCHEMBL7370628 0.84 PDE4A (0.52) PARP1NPSR1ATMTDO2KDM4E
SCHEMBL1249841 0.84 AURKA (0.54) PARP1NPSR1ATMMAP4K4FLT3
SCHEMBL1251253 0.83 NPSR1 (0.67) PARP1NPSR1ATMIDO1KDM4E
SCHEMBL7370355 0.81 PDE4A (0.48) CLK2DYRK1ACLK4KDM4ENPC1
SCHEMBL1252689 0.81 PARP1 (0.43) PARP1NPSR1ATMKDM4EALDH1A1
SCHEMBL9169239 0.81 PIM1 (0.55) PARP1NPSR1ATMTDO2KDM4E
SCHEMBL7362871 0.80 PDE4D (0.57) IDO1MAPTLMNAPDE4APDE4B
SCHEMBL1252788 0.79 IDO1 (0.55) PARP1NPSR1ATMCLK2DYRK1A
SCHEMBL1251585 0.79 NPSR1 (0.51) PARP1NPSR1ATMKDM4EALDH1A1

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
EP-0612321-A1 PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1994-08-31 EP disclosed
WO-1993007146-A1 BENZO AND PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1993-04-15 WO disclosed