SCHEMBL19985903

SCHEMBL19985903

c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4c5c6ccccc6c6ccccc6c5c5c6ccccc6sc5c43)c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TNKS O95271 2/20 0.33
TNKS2 Q9H2K2 2/20 0.33
KDM4E B2RXH2 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PTPN1 P18031 2/20 0.31
MAPT P10636 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
PTPRC P08575 1/20 0.30
PTPRF P10586 1/20 0.30
PTPRA P18433 1/20 0.30
PTPRB P23467 1/20 0.30
PTPN6 P29350 1/20 0.30
DUSP3 P51452 1/20 0.30
PTPN12 Q05209 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL17990808 0.94 TNKS (0.34) TNKSTNKS2KDM4EATML3MBTL1
SCHEMBL19985938 0.93 MAPT (0.36) TNKSTNKS2KDM4EATML3MBTL1
SCHEMBL19985937 0.91 MAPT (0.37) TNKSTNKS2KDM4EATML3MBTL1
SCHEMBL19985904 0.90 KDM4E (0.33) TNKSTNKS2KDM4EATML3MBTL1
SCHEMBL19985920 0.90 MAPT (0.36) TNKSTNKS2KDM4EATML3MBTL1
SCHEMBL19985919 0.90 L3MBTL1 (0.37) TNKSTNKS2KDM4EATML3MBTL1
SCHEMBL19985970 0.90 L3MBTL1 (0.37) TNKSTNKS2KDM4EATML3MBTL1
SCHEMBL17990833 0.89 TNKS (0.34) TNKSTNKS2KDM4EATML3MBTL1
SCHEMBL22960418 0.88 MAPT (0.36) TNKSTNKS2KDM4EATML3MBTL1
SCHEMBL17990832 0.88 TNKS (0.33) TNKSTNKS2KDM4EATML3MBTL1

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-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed