SCHEMBL23637472

SCHEMBL23637472

CC1(C)c2ccccc2-c2ccc(Nc3cccc4ccc5c6ccccc6oc5c34)cc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DUSP3 P51452 1/20 0.36
ALOX5 P09917 2/20 0.36
ALDH1A1 P00352 5/20 0.33
HPGD P15428 2/20 0.33
RAB9A P51151 1/20 0.33
FADS1 O60427 1/20 0.33
MEN1 O00255 6/20 0.32
KMT2A Q03164 6/20 0.32
POLB P06746 1/20 0.32
MAPK14 Q16539 1/20 0.32
PTGES2 Q9H7Z7 1/20 0.32
KDM4E B2RXH2 2/20 0.31
HTT P42858 1/20 0.31
RCE1 Q9Y256 1/20 0.31
MAPT P10636 2/20 0.31
CYP2C19 P33261 1/20 0.31
PGR P06401 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
EPHX2 P34913 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
SCHEMBL31470799 0.89 FADS1 (0.36) DUSP3ALDH1A1HPGDRAB9AFADS1
SCHEMBL23637331 0.89 FADS1 (0.36) DUSP3ALDH1A1HPGDRAB9AFADS1
SCHEMBL16185367 0.88 ALOX5 (0.40) DUSP3ALOX5ALDH1A1HPGDRAB9A
SCHEMBL29374585 0.88 ALOX5 (0.40) DUSP3ALOX5ALDH1A1HPGDRAB9A
SCHEMBL29386551 0.88 ALOX5 (0.40) DUSP3ALOX5ALDH1A1HPGDRAB9A
SCHEMBL23423854 0.88 DUSP3 (0.35) DUSP3ALDH1A1HPGDRAB9AFADS1
SCHEMBL24360613 0.86 ALOX5 (0.47) ALOX5ALDH1A1HPGDRAB9AMEN1
SCHEMBL29892122 0.86 ALOX5 (0.47) ALOX5ALDH1A1HPGDRAB9AMEN1
SCHEMBL19170359 0.85 ALDH1A1 (0.38) DUSP3ALOX5ALDH1A1HPGDRAB9A
SCHEMBL38651607 0.85 ALDH1A1 (0.38) DUSP3ALOX5ALDH1A1HPGDRAB9A

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-2021141356-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-07-15 WO disclosed