SCHEMBL19618525

SCHEMBL19618525

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cc(-n5c6ccccc6c6ccccc65)nc5ccc(-n6c7ccccc7c7ccccc76)cc45)cc3)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.41
KDM4E B2RXH2 5/20 0.39
ALDH1A1 P00352 5/20 0.39
HPGD P15428 4/20 0.39
MAPT P10636 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
MAPK1 P28482 2/20 0.39
LMNA P02545 2/20 0.39
HTT P42858 1/20 0.39
ATM Q13315 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
ACACA Q13085 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33
RAC2 P15153 1/20 0.33
RAC3 P60763 1/20 0.33
CDC42 P60953 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
SCHEMBL19618516 0.94 ALDH1A1 (0.45) EGFRKDM4EALDH1A1HPGDMAPT
SCHEMBL19618523 0.94 ALDH1A1 (0.45) EGFRKDM4EALDH1A1HPGDMAPT
SCHEMBL19618535 0.93 EGFR (0.37) EGFRKDM4EALDH1A1HPGDMAPT
SCHEMBL19618531 0.87 ALDH1A1 (0.38) EGFRKDM4EALDH1A1HPGDMAPT
SCHEMBL19618519 0.87 KDM4E (0.45) EGFRKDM4EALDH1A1HPGDMAPT
SCHEMBL19618538 0.87 KDM4E (0.45) EGFRKDM4EALDH1A1HPGDMAPT
SCHEMBL19618513 0.86 PIK3CA (0.44) EGFRKDM4EALDH1A1HPGDMAPT
SCHEMBL19618511 0.86 KDM4E (0.39) EGFRKDM4EALDH1A1HPGDMAPT
SCHEMBL21291348 0.86 EGFR (0.50) EGFRKDM4EALDH1A1HPGDMAPT
SCHEMBL19618532 0.85 MAPT (0.38) EGFRKDM4EALDH1A1HPGDMAPT

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