SCHEMBL4554075

SCHEMBL4554075

COc1n[nH]c(=O)c(-c2c(F)cc(F)cc2F)c1-c1ccc(F)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.37
RET P07949 1/20 0.36
KDR P35968 1/20 0.36
TYMP P19971 1/20 0.36
TNKS O95271 2/20 0.36
GSK3B P49841 2/20 0.35
GSK3A P49840 1/20 0.35
DYRK1A Q13627 1/20 0.35
SLC11A2 P49281 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
PARP2 Q9UGN5 1/20 0.34
NOTUM Q6P988 1/20 0.34
MAPK14 Q16539 1/20 0.34
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
USP2 O75604 1/20 0.34

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
SCHEMBL2354063 0.82 MAPT (0.41) MAPTRETKDRTYMPNOTUM
SCHEMBL2348136 0.79 DRD1 (0.43) MAPTGSK3BGSK3ADYRK1ANOTUM
SCHEMBL2352663 0.75 MAPT (0.43) MAPTRETKDRNOTUMMEN1
SCHEMBL3568770 0.74 NPC1 (0.36) DYRK1AMAPK14NPC1RAB9A
SCHEMBL2350128 0.73 IKBKB (0.39) MAPTTYMPNOTUMMEN1ALOX15
SCHEMBL2352300 0.72 AKT2 (0.49) TYMPSLC11A2MEN1NPC1RAB9A
SCHEMBL3579765 0.72 NPC1 (0.35) DYRK1AMAPK14NPC1RAB9A
SCHEMBL2352604 0.71 NOTUM (0.39) MAPTRETTNKSSLC11A2TNKS2
SCHEMBL2319405 0.70 DRD1 (0.35) MAPTRETKDRPRMT5WDR77
SCHEMBL1936292 0.69 DRD1 (0.41) MAPTRETKDRGSK3BGSK3A

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-2121628-A1 PYRIDAZINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS FUNGICIDES Syngenta Participations AG (CH) 2009-11-25 EP disclosed
WO-2008089934-A1 PYRIDAZINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2008-07-31 WO disclosed