SCHEMBL21382875

SCHEMBL21382875

c1ccc(-c2nc3ccccc3nc2-c2cccc(-c3ccc4ccnc5c4c3-c3ccccc3S5)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 6/20 0.36
KDM4E B2RXH2 6/20 0.34
LMNA P02545 4/20 0.34
ALDH1A1 P00352 4/20 0.34
GAA P10253 2/20 0.34
THRB P10828 1/20 0.33
KMT2A Q03164 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
MEN1 O00255 1/20 0.33
MAOA P21397 1/20 0.32
AKT1 P31749 1/20 0.32
AKT2 P31751 1/20 0.32
MAPK14 Q16539 5/20 0.32
ATM Q13315 1/20 0.32
TLR9 Q9NR96 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
MAPK10 P53779 1/20 0.31
PKM P14618 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
SCHEMBL21385095 0.82 IDO1 (0.34) ALDH1A1KMT2AMEN1MAOAMAPK10
SCHEMBL21382847 0.74 LPL (0.35)
SCHEMBL21382889 0.71 L3MBTL1 (0.41) L3MBTL1KDM4ELMNAALDH1A1GAA
SCHEMBL21382879 0.71 ALDH1A1 (0.38) KDM4ELMNAALDH1A1GAAMAOA
SCHEMBL24689816 0.69 L3MBTL1 (0.58) L3MBTL1KDM4ELMNAALDH1A1GAA
SCHEMBL21385276 0.67 BIRC5 (0.35) KDM4ELMNAALDH1A1MAPK10
SCHEMBL12617937 0.65 CYP1A2 (0.46) L3MBTL1KDM4ELMNAALDH1A1GAA
SCHEMBL23546638 0.65 L3MBTL1 (0.49) L3MBTL1KDM4ELMNAALDH1A1GAA
SCHEMBL18504119 0.65 KDM4E (0.59) L3MBTL1KDM4ELMNAALDH1A1GAA
SCHEMBL22963536 0.64 LMNA (0.44) L3MBTL1KDM4ELMNAALDH1A1GAA

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-2019182360-A1 COMPOUND, ORGANIC LIGHT-EMITTING DEVICE AND DISPLAY DEVICE 에스케이머티리얼즈 주식회사 2019-09-26 WO disclosed