SCHEMBL17809102

SCHEMBL17809102

c1ccc(-c2cccc(-c3ccc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccc(-c8cc(-c9ccccc9)cc(-c9ccccc9)n8)cc7)c6c54)cc3)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ATM Q13315 1/20 0.40
CYP19A1 P11511 1/20 0.37
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
DHODH Q02127 1/20 0.36
NR3C1 P04150 1/20 0.36
MAPT P10636 3/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
MAPK1 P28482 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HDAC4 P56524 1/20 0.35
RAB9A P51151 1/20 0.35
MCL1 Q07820 2/20 0.35
ACHE P22303 1/20 0.34
MYC P01106 1/20 0.34
CTRC Q99895 1/20 0.33
HSP90AA1 P07900 1/20 0.33

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
SCHEMBL22595662 1.00 KDM4E (0.40) KDM4EL3MBTL1ATMCYP19A1KMT2A
SCHEMBL22595870 0.99 L3MBTL1 (0.42) KDM4EL3MBTL1ATMCYP19A1KMT2A
SCHEMBL17809109 0.96 KDM4E (0.41) KDM4EL3MBTL1ATMCYP19A1KMT2A
SCHEMBL17809184 0.96 KDM4E (0.43) KDM4EL3MBTL1ATMCYP19A1KMT2A
SCHEMBL17809116 0.96 KDM4E (0.43) KDM4EL3MBTL1ATMCYP19A1KMT2A
SCHEMBL17809115 0.95 KDM4E (0.40) KDM4EL3MBTL1ATMCYP19A1KMT2A
SCHEMBL22595845 0.95 L3MBTL1 (0.41) KDM4EL3MBTL1ATMCYP19A1KMT2A
SCHEMBL17809169 0.95 L3MBTL1 (0.41) KDM4EL3MBTL1ATMCYP19A1KMT2A
SCHEMBL17809195 0.95 L3MBTL1 (0.41) KDM4EL3MBTL1ATMCYP19A1KMT2A
SCHEMBL17809124 0.95 L3MBTL1 (0.41) KDM4EL3MBTL1ATMCYP19A1KMT2A

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