SCHEMBL22707709

SCHEMBL22707709

Cn1c2ccccc2c2cccc(-c3cccc4c(-c5cccc6c5-c5ccccc5C6(C)C)c5cccc(-c6cccc7c8ccccc8n(C)c67)c5cc34)c21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALKBH5 Q6P6C2 1/20 0.41
FTO Q9C0B1 1/20 0.41
HSP90AA1 P07900 1/20 0.38
IDO1 P14902 1/20 0.38
GPR3 P46089 1/20 0.36
NTRK1 P04629 2/20 0.33
KDM4E B2RXH2 5/20 0.32
MAPT P10636 4/20 0.32
ALDH1A1 P00352 4/20 0.31
HPGD P15428 4/20 0.31
LMNA P02545 2/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HSD17B10 Q99714 4/20 0.31
KDR P35968 1/20 0.31
MEN1 O00255 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL22705890 0.88 ALKBH5 (0.41) ALKBH5FTOHSP90AA1IDO1GPR3
SCHEMBL22707143 0.88 ALKBH5 (0.41) ALKBH5FTOHSP90AA1IDO1GPR3
SCHEMBL22706937 0.88 KDM4E (0.31) ALKBH5FTOKDM4EMAPTALDH1A1
SCHEMBL22707711 0.85 GPR3 (0.36) GPR3NTRK1KDM4EMAPTALDH1A1
SCHEMBL22707146 0.85 ALKBH5 (0.39) ALKBH5FTOHSP90AA1IDO1GPR3
SCHEMBL22706909 0.85 ALKBH5 (0.39) ALKBH5FTOHSP90AA1IDO1GPR3
SCHEMBL22707174 0.85 KDM4E (0.38) KDM4EL3MBTL1DUSP3
SCHEMBL22707124 0.85 ALKBH5 (0.39) ALKBH5FTOHSP90AA1IDO1GPR3
SCHEMBL22705850 0.85 ALKBH5 (0.39) ALKBH5FTOHSP90AA1IDO1GPR3
SCHEMBL20334569 0.84 ALKBH5 (0.53) ALKBH5FTOHSP90AA1IDO1GPR3

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
US-20200373496-A1 ORGANIC LIGHT EMITTING ELEMENT LG CHEM, LTD. (KR) 2020-11-26 US disclosed