SCHEMBL22705809

SCHEMBL22705809

CC1(C)c2ccccc2-c2cc(-c3c4cccc(-c5ccc6oc7ccccc7c6c5)c4cc4c(-c5ccc6oc7ccccc7c6c5)cccc34)ccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.39
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 2/20 0.38
KMT2A Q03164 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSP90AA1 P07900 1/20 0.37
HSP90AB1 P08238 1/20 0.37
PGR P06401 1/20 0.34
MAOA P21397 1/20 0.33
ALK Q9UM73 1/20 0.32
IDO1 P14902 1/20 0.32
AHR P35869 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
CASP3 P42574 1/20 0.31
SENP7 Q9BQF6 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
SCHEMBL22007457 0.94 MAPT (0.42) ALOX5KDM4EMEN1ALDH1A1MAPT
SCHEMBL22707001 0.93 ALOX5 (0.39) ALOX5KDM4EMEN1ALDH1A1MAPT
SCHEMBL22706480 0.93 ALOX5 (0.39) ALOX5KDM4EMEN1ALDH1A1MAPT
SCHEMBL17944849 0.93 MAOA (0.39) ALOX5KDM4EMEN1ALDH1A1MAPT
SCHEMBL17945036 0.91 KDM4E (0.39) ALOX5KDM4EMEN1ALDH1A1MAPT
SCHEMBL17944079 0.89 KDM4E (0.38) ALOX5KDM4EMEN1ALDH1A1MAPT
SCHEMBL23502242 0.88 MEN1 (0.37) ALOX5KDM4EMEN1ALDH1A1MAPT
SCHEMBL13487501 0.87 PLA2G2A (0.38) ALOX5KDM4EMEN1ALDH1A1MAPT
SCHEMBL13487738 0.87 MEN1 (0.37) ALOX5KDM4EMEN1ALDH1A1MAPT
SCHEMBL17944851 0.87 ALOX5 (0.40) ALOX5KDM4EMEN1ALDH1A1MAPT

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