SCHEMBL17622374

SCHEMBL17622374

O=S1(=O)OS(=O)(=O)c2c(-n3c4ccccc4c4ccccc43)cccc21

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
POLB P06746 1/20 0.33
DUSP3 P51452 1/20 0.31
GPR3 P46089 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.30
TFPI2 P48307 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
SCHEMBL17622389 0.74 ALDH1A1 (0.40) ALDH1A1KDM4EATML3MBTL1POLB
SCHEMBL17622375 0.73 KDM4E (0.43) ALDH1A1KDM4EATML3MBTL1
SCHEMBL17622379 0.71 ALDH1A1 (0.37) ALDH1A1KDM4EATML3MBTL1DUSP3
SCHEMBL14557135 0.70 ALDH1A1 (0.55) ALDH1A1KDM4EATML3MBTL1POLB
SCHEMBL30572834 0.70 ALDH1A1 (0.59) ALDH1A1KDM4EATML3MBTL1POLB
SCHEMBL546098 0.70 ALDH1A1 (0.59) ALDH1A1KDM4EATML3MBTL1POLB
SCHEMBL12324491 0.68 ALDH1A1 (0.39) ALDH1A1KDM4EATML3MBTL1POLB
SCHEMBL139164 0.67 GPR3 (0.46) KDM4EGPR3
SCHEMBL3796004 0.67 ALDH1A1 (0.52) ALDH1A1KDM4EATML3MBTL1POLB
SCHEMBL16482198 0.66 ALDH1A1 (0.47) ALDH1A1KDM4EATML3MBTL1POLB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3246373-A1 ORGANIC MOLECULES FOR USE AS EMITTERS cynora GmbH (DE) 2017-11-22 EP disclosed
US-20170288149-A1 ORGANIC MOLECULES FOR USE AS EMITTERS CYNORA GMBH (DE) 2017-10-05 US disclosed
US-20170288149-A1 ORGANIC MOLECULES FOR USE AS EMITTERS CYNORA GMBH (DE) 2017-10-05 US disclosed
WO-2016042070-A1 ORGANIC MOLECULES FOR USE AS EMITTERS CYNORA GMBH (DE) 2016-03-24 WO disclosed