SCHEMBL16996363

SCHEMBL16996363

N#Cc1ccc(N(c2ccc(-c3cccc4c3oc3ccccc34)cc2)c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)cc1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.41
TNKS O95271 1/20 0.38
PRKDC P78527 4/20 0.38
PDK2 Q15119 3/20 0.36
GGPS1 O95749 1/20 0.33
CCNT1 O60563 1/20 0.32
CDK9 P50750 1/20 0.32
PTGES2 Q9H7Z7 1/20 0.31
AR P10275 2/20 0.30

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
SCHEMBL16996057 0.94 ALOX5 (0.39) ALOX5TNKSPRKDCPDK2GGPS1
SCHEMBL16998980 0.94 ALOX5 (0.39) ALOX5TNKSPRKDCPDK2GGPS1
SCHEMBL9917171 0.93 ALOX5 (0.38) ALOX5TNKSPRKDCPDK2GGPS1
SCHEMBL16998977 0.93 ALOX5 (0.38) ALOX5TNKSPRKDCPDK2GGPS1
SCHEMBL16996356 0.92 ALOX5 (0.48) ALOX5TNKSPRKDCGGPS1PTGES2
SCHEMBL26999797 0.92 ALOX5 (0.48) ALOX5TNKSPRKDCGGPS1PTGES2
SCHEMBL19530839 0.91 ALOX5 (0.47) ALOX5TNKSPRKDCGGPS1PTGES2
SCHEMBL16998981 0.90 ALOX5 (0.37) ALOX5TNKSPRKDCPDK2GGPS1
SCHEMBL16996301 0.90 ALOX5 (0.46) ALOX5TNKSPRKDCPDK2GGPS1
SCHEMBL17859220 0.89 ALOX5 (0.39) ALOX5TNKSPRKDCPDK2GGPS1

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
US-20150228899-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2015-08-13 US disclosed
US-20150228899-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2015-08-13 US disclosed