SCHEMBL23637470

SCHEMBL23637470

CC1(C)c2ccccc2-c2ccc(Nc3cc4c5ccccc5oc4c4ccccc34)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.39
HPGD P15428 4/20 0.39
RAB9A P51151 2/20 0.39
ALOX5 P09917 2/20 0.37
KDM4E B2RXH2 5/20 0.37
HTT P42858 2/20 0.37
PDK2 Q15119 3/20 0.36
LMNA P02545 3/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
CYP2C19 P33261 1/20 0.34
DYRK1A Q13627 1/20 0.33
AHR P35869 1/20 0.33
PGR P06401 1/20 0.32
MAPT P10636 3/20 0.31
NPSR1 Q6W5P4 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 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
SCHEMBL29386551 0.89 ALOX5 (0.40) ALDH1A1HPGDRAB9AALOX5KDM4E
SCHEMBL29374585 0.89 ALOX5 (0.40) ALDH1A1HPGDRAB9AALOX5KDM4E
SCHEMBL16185367 0.89 ALOX5 (0.40) ALDH1A1HPGDRAB9AALOX5KDM4E
SCHEMBL29892122 0.87 ALOX5 (0.47) ALDH1A1HPGDRAB9AALOX5KDM4E
SCHEMBL24360613 0.87 ALOX5 (0.47) ALDH1A1HPGDRAB9AALOX5KDM4E
SCHEMBL23637471 0.85 ALOX5 (0.36) ALDH1A1HPGDRAB9AALOX5KDM4E
SCHEMBL22245926 0.84 ALDH1A1 (0.39) ALDH1A1HPGDRAB9AKDM4EHTT
SCHEMBL19844387 0.83 ALDH1A1 (0.38) ALDH1A1HPGDRAB9AKDM4EHTT
SCHEMBL23637472 0.83 DUSP3 (0.36) ALDH1A1HPGDRAB9AALOX5KDM4E
SCHEMBL9916963 0.83 ALOX5 (0.46) ALDH1A1HPGDRAB9AALOX5KDM4E

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