SCHEMBL23867302

SCHEMBL23867302

c1ccc(-c2ccccc2-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3cccc4c3sc3ccccc34)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.39
PRKDC P78527 3/20 0.35
F9 P00740 1/20 0.34
NPC1 O15118 2/20 0.32
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
PIK3CD O00329 1/20 0.31
BRD4 O60885 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
MTOR P42345 1/20 0.31
PIK3CG P48736 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
SCHEMBL23867303 0.99 ALOX5 (0.38) ALOX5PRKDCF9NPC1MAPT
SCHEMBL23867256 0.95 ALOX5 (0.39) ALOX5PRKDCF9MAPTKDM4E
SCHEMBL15964407 0.95 ALOX5 (0.36) ALOX5PRKDCNPC1MAPTKDM4E
SCHEMBL15964408 0.95 ALOX5 (0.36) ALOX5PRKDCNPC1MAPTKDM4E
SCHEMBL23313392 0.94 ALOX5 (0.38) ALOX5PRKDCF9HSP90AA1HSP90AB1
SCHEMBL23313875 0.94 ALOX5 (0.38) ALOX5PRKDCF9HSP90AA1HSP90AB1
SCHEMBL23867257 0.94 PRKDC (0.39) ALOX5PRKDCF9MAPTKDM4E
SCHEMBL22255614 0.93 ALOX5 (0.34) ALOX5PRKDCF9NPC1MAPT
SCHEMBL23867455 0.93 ALOX5 (0.38) ALOX5PRKDCF9NPC1MAPT
SCHEMBL23313389 0.92 ALOX5 (0.36) ALOX5PRKDCPLA2G10PLA2G2APLA2G4A

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
US-20210305509-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND AMINE COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2021-09-30 US disclosed