SCHEMBL17809205

SCHEMBL17809205

c1ccc(-c2cc(-c3ccc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccc8sc9ccccc9c8c7)c6c54)cc3)nc(-c3ccccc3)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.37
MEN1 O00255 8/20 0.37
MAPT P10636 8/20 0.37
HPGD P15428 8/20 0.37
ALDH1A1 P00352 7/20 0.37
NTSR1 P30989 1/20 0.37
KDM4E B2RXH2 6/20 0.34
LMNA P02545 2/20 0.34
GLA P06280 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
ATM Q13315 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
NPSR1 Q6W5P4 2/20 0.32
RXFP1 Q9HBX9 1/20 0.32
CYP2C19 P33261 1/20 0.32
PTK2B Q14289 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL17809210 1.00 KMT2A (0.37) KMT2AMEN1MAPTHPGDALDH1A1
SCHEMBL17809212 0.99 KMT2A (0.36) KMT2AMEN1MAPTHPGDALDH1A1
SCHEMBL17809211 0.94 ATM (0.36) KMT2AMEN1MAPTHPGDALDH1A1
SCHEMBL17809217 0.93 MEN1 (0.35) KMT2AMEN1MAPTHPGDALDH1A1
SCHEMBL17809224 0.92 MAPT (0.37) KMT2AMEN1MAPTHPGDALDH1A1
SCHEMBL17809219 0.92 MAPT (0.37) KMT2AMEN1MAPTHPGDALDH1A1
SCHEMBL17809216 0.92 MAPT (0.38) KMT2AMEN1MAPTHPGDALDH1A1
SCHEMBL17809209 0.91 KDM4E (0.33) KMT2AMEN1MAPTHPGDALDH1A1
SCHEMBL17809220 0.90 L3MBTL1 (0.31) MAPTHPGDALDH1A1KDM4EL3MBTL1
SCHEMBL17809214 0.90 CYP1A2 (0.32) KMT2AMEN1MAPTHPGDALDH1A1

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