SCHEMBL15089164

SCHEMBL15089164

c1cc2c3c(ccc(-c4ccncc4)c3c1)-c1cc3c4cc(-c5ccncc5)ccc4n(-c4ccncc4)c3cc1N2c1ccncc1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 2/20 0.34
PRKCI P41743 1/20 0.33
DRD2 P14416 1/20 0.31
MEN1 O00255 1/20 0.31
HSP90AA1 P07900 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL15088862 0.96 PIK3CA (0.38) PIK3CAPRKCIMEN1HSP90AA1MAPT
SCHEMBL15089046 0.88 KDM4E (0.40) PIK3CADRD2MEN1HSP90AA1MAPT
SCHEMBL15088803 0.88 PDE6D (0.36) HSP90AA1
SCHEMBL15088870 0.88 PDE6D (0.38)
SCHEMBL15088848 0.86 PDE6D (0.37)
SCHEMBL15089260 0.84 PDE6D (0.46) PIK3CAMEN1HSP90AA1MAPTKMT2A
SCHEMBL15089143 0.83 PDE6D (0.45) PIK3CAMEN1HSP90AA1MAPTKMT2A
SCHEMBL15088861 0.83 CYP1A2 (0.36) PIK3CAMAPT
SCHEMBL15088846 0.83 ATM (0.35) HSP90AA1
SCHEMBL15088928 0.82 PDE6D (0.32) PIK3CA

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
WO-2013100497-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 주식회사 두산 (KR) 2013-07-04 WO disclosed