SCHEMBL19918576

SCHEMBL19918576

c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5cc(-c6ccc7oc8cc9c%10c(cccc%10c8c7c6)-c6ccccc6-9)ccc54)ccc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
ALDH1A1 P00352 2/20 0.32
TSHR P16473 2/20 0.32
HSD17B10 Q99714 2/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
BRCA1 P38398 1/20 0.32
KMT2A Q03164 1/20 0.32
EDNRB P24530 1/20 0.31
EDNRA P25101 1/20 0.31
PLA2G2A P14555 2/20 0.31
PLA2G4A P47712 2/20 0.31
PLA2G10 O15496 1/20 0.31
HPGD P15428 1/20 0.31
MAPK1 P28482 1/20 0.31
CASP1 P29466 1/20 0.31
HIF1A Q16665 1/20 0.31
TSPO P30536 1/20 0.31

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
SCHEMBL19918437 0.97 L3MBTL1 (0.42) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL19918565 0.96 KDM4E (0.38) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL19918568 0.96 L3MBTL1 (0.36) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL19918431 0.94 L3MBTL1 (0.37) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL19918434 0.94 ATM (0.36) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL19918436 0.94 ATM (0.36) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL19918433 0.94 L3MBTL1 (0.31) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL19918438 0.94 L3MBTL1 (0.36) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL19918564 0.94 HSP90AA1 (0.33) L3MBTL1KDM4EATMALDH1A1TSHR
SCHEMBL19918435 0.93 ATM (0.35) L3MBTL1KDM4EATMALDH1A1TSHR

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018038400-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING SAME 주식회사 두산 2018-03-01 WO disclosed