SCHEMBL17990902

SCHEMBL17990902

c1ccc(-c2cc(-c3ccccc3)cc(-c3cccc(-n4c5ccccc5c5ccc6c(ccc7c8ccccc8sc76)c54)c3)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.37
KDM4E B2RXH2 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAPT P10636 3/20 0.37
RXFP1 Q9HBX9 1/20 0.37
TNKS O95271 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35
ALOX5 P09917 1/20 0.35
TP53 P04637 2/20 0.35
ALDH1A1 P00352 2/20 0.32
HSD17B10 Q99714 1/20 0.32
FAAH O00519 1/20 0.32
HSP90AA1 P07900 1/20 0.32
PKM P14618 1/20 0.32
HTT P42858 1/20 0.32
MGLL Q99685 1/20 0.32
OPRD1 P41143 1/20 0.31
LIMK1 P53667 2/20 0.31
GPR3 P46089 1/20 0.31
KMT2A Q03164 2/20 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
SCHEMBL17246446 0.95 ATM (0.37) ATMKDM4EL3MBTL1MAPTRXFP1
SCHEMBL17990838 0.94 TNKS (0.37) ATMKDM4EL3MBTL1MAPTRXFP1
SCHEMBL26413294 0.93 TNKS (0.36) ATMKDM4EL3MBTL1MAPTRXFP1
SCHEMBL10014565 0.93 ATM (0.39) ATMKDM4EL3MBTL1MAPTRXFP1
SCHEMBL26413297 0.92 TNKS (0.37) ATMKDM4EL3MBTL1MAPTRXFP1
SCHEMBL17246401 0.91 TNKS (0.36) ATMKDM4EL3MBTL1MAPTRXFP1
SCHEMBL19287660 0.91 LIMK1 (0.36) ATMKDM4EL3MBTL1MAPTRXFP1
SCHEMBL24676255 0.90 MAPT (0.39) ATMKDM4EL3MBTL1MAPTRXFP1
SCHEMBL12447588 0.90 ALOX5 (0.41) ATMKDM4EL3MBTL1MAPTRXFP1
SCHEMBL24676369 0.89 KDM4E (0.40) ATMKDM4EL3MBTL1MAPTRXFP1

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-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 US disclosed
US-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 US disclosed