SCHEMBL17809244

SCHEMBL17809244

c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7cccc8c7sc7ccccc78)c6c54)cc3)c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
ALOX5 P09917 1/20 0.33
KDM4E B2RXH2 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
ATM Q13315 1/20 0.32
PRKDC P78527 1/20 0.31
MAPT P10636 2/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
CYP19A1 P11511 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
MAPK1 P28482 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30
DHODH Q02127 1/20 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
SCHEMBL17809245 0.94 TNKS (0.32) TNKSTNKS2ALOX5KDM4EL3MBTL1
SCHEMBL17809250 0.94 MEN1 (0.34) TNKSTNKS2ALOX5KDM4EL3MBTL1
SCHEMBL17809247 0.93 KMT2A (0.35) TNKSTNKS2ALOX5KDM4EL3MBTL1
SCHEMBL17809242 0.93 KMT2A (0.35) TNKSTNKS2ALOX5KDM4EL3MBTL1
SCHEMBL17246430 0.93 KDM4E (0.34) TNKSTNKS2ALOX5KDM4EL3MBTL1
SCHEMBL17809252 0.93 TNKS (0.35) TNKSTNKS2ALOX5KDM4EL3MBTL1
SCHEMBL17809255 0.92 TNKS (0.33) TNKSTNKS2ALOX5KDM4EL3MBTL1
SCHEMBL15583115 0.91 L3MBTL1 (0.38) TNKSTNKS2ALOX5KDM4EL3MBTL1
SCHEMBL17809260 0.90 TNKS (0.33) TNKSTNKS2ALOX5KDM4EPRKDC
SCHEMBL17809316 0.89 ALOX5 (0.35) TNKSTNKS2ALOX5KDM4EL3MBTL1

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-20160163995-A1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2016-06-09 US disclosed
US-20160163995-A1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2016-06-09 US disclosed