SCHEMBL22986982

SCHEMBL22986982

CC1(C)c2ccccc2-c2cc(-c3nc(-c4ccccc4)nc(-c4cccc5c4oc4ccccc45)n3)ccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.42
MAPT P10636 7/20 0.37
TSHR P16473 3/20 0.37
LMNA P02545 3/20 0.37
POLB P06746 2/20 0.37
GGPS1 O95749 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 2/20 0.36
NPSR1 Q6W5P4 1/20 0.35
HSD17B10 Q99714 2/20 0.35
USP2 O75604 1/20 0.35
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
PRKDC P78527 2/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CB P42338 1/20 0.33
GAA P10253 1/20 0.33
PTGES2 Q9H7Z7 1/20 0.33

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
SCHEMBL21707335 0.95 ALOX5 (0.38) ALOX5MAPTTSHRLMNAPOLB
SCHEMBL22061726 0.95 ALOX5 (0.40) ALOX5MAPTTSHRLMNAPOLB
SCHEMBL22309447 0.94 ALOX5 (0.38) ALOX5MAPTTSHRLMNAPOLB
SCHEMBL15501784 0.94 ALOX5 (0.42) ALOX5MAPTTSHRLMNAPOLB
SCHEMBL24097624 0.93 ALOX5 (0.45) ALOX5MAPTTSHRLMNAPOLB
SCHEMBL17425590 0.92 ALDH1A1 (0.34) ALOX5MAPTTSHRLMNAHTT
SCHEMBL27069083 0.92 ALOX5 (0.38) ALOX5MAPTTSHRLMNAPOLB
SCHEMBL22243897 0.92 ALOX5 (0.39) ALOX5MAPTTSHRLMNAPOLB
SCHEMBL22308640 0.91 ALOX5 (0.39) ALOX5MAPTTSHRLMNAPOLB
SCHEMBL27069411 0.91 ALOX5 (0.37) ALOX5MAPTTSHRLMNAPOLB

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-20210050528-A1 ORGANIC LIGHT EMITTING DIODE LG CHEM, LTD. (KR) 2021-02-18 US disclosed