SCHEMBL10316447

SCHEMBL10316447

CC(C)c1ccc2c(c1)c1ncccc1n2C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.43
ADORA2A P29274 1/20 0.43
MAPK14 Q16539 1/20 0.37
RORA P35398 1/20 0.36
RORC P51449 1/20 0.36
RORB Q92753 1/20 0.36
GPR3 P46089 1/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
HCRTR1 O43613 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 1/20 0.35
DGKI O75912 1/20 0.35
DGKA P23743 1/20 0.35
DGKZ Q13574 1/20 0.35
PARP15 Q460N3 1/20 0.35
PARP10 Q53GL7 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35
PARP2 Q9UGN5 1/20 0.35
MAPT P10636 2/20 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
SCHEMBL20172101 0.80 KDM4E (0.41) RORARORCRORBMEN1KMT2A
SCHEMBL13911852 0.80 MEN1 (0.53) ADORA3ADORA2AMAPK14GPR3MEN1
SCHEMBL13183748 0.79 ADORA3 (0.50) ADORA3ADORA2AMAPK14GPR3MEN1
SCHEMBL12083594 0.78 RORA (0.46) RORARORCRORBGPR3MEN1
SCHEMBL1102397 0.77 GPR3 (0.59) RORARORCRORBGPR3MEN1
SCHEMBL31232963 0.77 GPR3 (0.58) ADORA3ADORA2AMAPK14GPR3KMT2A
SCHEMBL1609786 0.77 GPR3 (0.58) ADORA3ADORA2AMAPK14GPR3KMT2A
SCHEMBL14329568 0.76 ADORA3 (0.43) ADORA3ADORA2AMAPK14GPR3MEN1
SCHEMBL16625726 0.76 LIMK1 (0.43) ADORA3ADORA2AMAPK14GPR3MEN1
SCHEMBL12417360 0.76 ADORA3 (0.43) ADORA3ADORA2AMAPK14GPR3MEN1

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
EP-2475020-A1 ORGANIC ELECTROLUMINESCENT ELEMENT FUJIFILM Corporation (JP) 2012-07-11 EP disclosed