SCHEMBL7095283

SCHEMBL7095283

In1ncc2c1-c1ccccc1C2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.41
MAPK8 P45983 2/20 0.41
MAPK9 P45984 2/20 0.41
PLK4 O00444 1/20 0.41
DAPK3 O43293 1/20 0.41
PIM1 P11309 1/20 0.41
PDGFRA P16234 1/20 0.41
LTK P29376 1/20 0.41
MAP2K2 P36507 1/20 0.41
FLT3 P36888 1/20 0.41
CSNK1A1 P48729 1/20 0.41
TDO2 P48775 1/20 0.41
CDK8 P49336 1/20 0.41
CDK5 Q00535 1/20 0.41
MAP2K1 Q02750 1/20 0.41
MST1R Q04912 1/20 0.41
PTK2 Q05397 1/20 0.41
MAP4K2 Q12851 1/20 0.41
ROCK1 Q13464 1/20 0.41
DYRK1A Q13627 1/20 0.41

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
SCHEMBL4809703 0.79 MAOA (0.42) MAOAMAPK8MAPK9PLK4DAPK3
SCHEMBL19582587 0.78 HIF1A (0.47) MAOAMAPK8MAPK9PLK4DAPK3
SCHEMBL8019722 0.75 HIF1A (0.50) MAOAMAPK8MAPK9PLK4DAPK3
SCHEMBL16314143 0.74 RNASEH1 (0.37) MAOAMAPK8MAPK9PLK4DAPK3
Ammonia Solution, Strong SCHEMBL4359394 0.73 MEN1 (0.44) MAOAMAPK8MAPK9PLK4DAPK3
SCHEMBL5945476 0.71 DAPK3 (0.36) MAOAMAPK8MAPK9PLK4DAPK3
SCHEMBL4359389 0.71 HTR2C (0.40) MAOAMAPK8MAPK9PLK4DAPK3
SCHEMBL7696846 0.69 HIF1A (0.40) MAPTSMN1; SMN2MEN1KMT2ANPC1
Fluorene SCHEMBL29355380 0.67 MAOA (0.68) MAOAMAPK8MAPK9PLK4DAPK3
Fluorene SCHEMBL29478468 0.67 MAOA (0.68) MAOAMAPK8MAPK9PLK4DAPK3

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-1268437-A1 INHIBITORS OF PROTEIN KINASES Knoll GmbH (DE) 2003-01-02 EP disclosed
WO-2002030908-A1 INHIBITORS OF PROTEIN KINASES KNOLL GMBH (DE) 2002-04-18 WO disclosed