SCHEMBL17809367

SCHEMBL17809367

c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6cccc7c6sc6ccccc67)c45)cc3)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
HPGD P15428 2/20 0.32
NTSR1 P30989 1/20 0.32
KDM4E B2RXH2 2/20 0.32
LMNA P02545 1/20 0.32
GLA P06280 1/20 0.32
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TNKS O95271 1/20 0.30
TNKS2 Q9H2K2 1/20 0.30
ALOX5 P09917 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
SCHEMBL21365530 0.94 KDM4E (0.33) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL21365789 0.92 ALOX5 (0.32) KDM4EATML3MBTL1ALOX5
SCHEMBL17809247 0.91 KMT2A (0.35) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL17809242 0.91 KMT2A (0.35) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL17809250 0.91 MEN1 (0.34) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL24991271 0.89 KDM4E (0.37) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL18124906 0.89 KDM4E (0.37) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL24914601 0.89 KDM4E (0.32) MAPTKDM4EATML3MBTL1TNKS
SCHEMBL18124941 0.88 KDM4E (0.35) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL10014510 0.88 KMT2A (0.37) MEN1KMT2AALDH1A1MAPTHPGD

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