SCHEMBL19618569

SCHEMBL19618569

c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)nc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc45)c3)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ATM Q13315 1/20 0.40
ALDH1A1 P00352 5/20 0.38
MAPT P10636 4/20 0.38
MAPK1 P28482 3/20 0.38
TDP1 Q9NUW8 2/20 0.38
HPGD P15428 2/20 0.38
PTGES O14684 1/20 0.38
ACACA Q13085 3/20 0.38
LMNA P02545 4/20 0.37
NPSR1 Q6W5P4 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
RECQL P46063 1/20 0.37
AURKA O14965 1/20 0.37
AURKB Q96GD4 1/20 0.37
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
DHODH Q02127 1/20 0.36

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
SCHEMBL19618566 0.99 KDM4E (0.41) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL19618565 0.95 ALDH1A1 (0.42) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL19618567 0.95 ALDH1A1 (0.42) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL19618564 0.91 KDM4E (0.40) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL19618562 0.91 KDM4E (0.40) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL11992472 0.91 L3MBTL1 (0.49) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL4546991 0.91 L3MBTL1 (0.49) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL19618551 0.90 MAPT (0.46) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL16942574 0.90 KDM4E (0.41) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL16942576 0.90 KDM4E (0.41) KDM4EL3MBTL1ATMALDH1A1MAPT

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-9825242-B2 Compound for organic optoelectric device, organic light-emitting diode including same, display device including organic light-emitting diode CHEIL INDUSTRIES, INC. (KR) 2017-11-21 US disclosed
US-9825242-B2 Compound for organic optoelectric device, organic light-emitting diode including same, display device including organic light-emitting diode CHEIL INDUSTRIES, INC. (KR) 2017-11-21 US disclosed