SCHEMBL22706191

SCHEMBL22706191

c1ccc(-c2c3cccc(-c4ccc5c6ccccc6n6c7ccccc7c4c56)c3cc3c(-c4ccc5c6ccccc6n6c7ccccc7c4c56)cccc23)cc1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.33
IDO1 P14902 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MAPK14 Q16539 1/20 0.32
KDM4E B2RXH2 2/20 0.31
MEN1 O00255 2/20 0.31
MAPT P10636 2/20 0.31
KMT2A Q03164 2/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
THRA P10827 1/20 0.30
THRB P10828 1/20 0.30
DUSP3 P51452 1/20 0.30
RECQL P46063 1/20 0.30
PLEC Q15149 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL22706188 0.99 HSP90AA1 (0.32) HSP90AA1IDO1HSD17B10MAPK14KDM4E
SCHEMBL22707539 0.99 HSP90AA1 (0.32) HSP90AA1IDO1HSD17B10MAPK14KDM4E
SCHEMBL22706149 0.97 HSP90AA1 (0.32) HSP90AA1IDO1HSD17B10MAPK14
SCHEMBL22707879 0.95 KDM4E (0.32) HSP90AA1IDO1HSD17B10KDM4EMEN1
SCHEMBL22707928 0.93 MAPK14 (0.36) HSP90AA1IDO1HSD17B10MAPK14KDM4E
SCHEMBL22706638 0.92 HSD17B10 (0.34) HSP90AA1IDO1HSD17B10MAPK14KDM4E
SCHEMBL22706264 0.88 KDM4E (0.33) HSD17B10MAPK14KDM4EMEN1MAPT
SCHEMBL22706192 0.88 KDM4E (0.34) HSD17B10KDM4EMEN1MAPTKMT2A
SCHEMBL22706189 0.86 KDM4E (0.33) HSD17B10KDM4EMEN1MAPTKMT2A
SCHEMBL22707155 0.86 ALDH1A1 (0.34) HSP90AA1IDO1HSD17B10KDM4EMEN1

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