SCHEMBL23637430

SCHEMBL23637430

CC1(C)c2ccccc2-c2ccc(Nc3cccc4c3oc3ccncc34)cc21

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.32
ALDH1A1 P00352 4/20 0.32
KMT2A Q03164 4/20 0.32
LMNA P02545 3/20 0.32
HPGD P15428 2/20 0.32
KDM4E B2RXH2 2/20 0.32
HSD17B10 Q99714 2/20 0.32
POLB P06746 2/20 0.32
KDR P35968 3/20 0.31
ALOX5 P09917 1/20 0.31
BRAF P15056 3/20 0.31
EIF2AK3 Q9NZJ5 2/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TSHR P16473 1/20 0.30
HTT P42858 1/20 0.30
NAMPT P43490 1/20 0.30
PIM1 P11309 1/20 0.30
PIM2 Q9P1W9 1/20 0.30
PDK2 Q15119 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
SCHEMBL29386551 0.88 ALOX5 (0.40) ALDH1A1KMT2ALMNAHPGDKDM4E
SCHEMBL29374585 0.88 ALOX5 (0.40) ALDH1A1KMT2ALMNAHPGDKDM4E
SCHEMBL16185367 0.88 ALOX5 (0.40) ALDH1A1KMT2ALMNAHPGDKDM4E
SCHEMBL29892122 0.82 ALOX5 (0.47) ALDH1A1KMT2ALMNAHPGDKDM4E
SCHEMBL24360613 0.82 ALOX5 (0.47) ALDH1A1KMT2ALMNAHPGDKDM4E
SCHEMBL18729420 0.82 ALOX5 (0.38) ALDH1A1KMT2ALMNAHPGDKDM4E
SCHEMBL22680242 0.80 PDK2 (0.35) ALDH1A1KMT2ALMNAKDM4EHSD17B10
SCHEMBL18471153 0.79 FADS1 (0.34) MAPK14ALDH1A1KMT2AHPGDHSD17B10
SCHEMBL23637474 0.79 MAPK14 (0.36) MAPK14ALDH1A1KMT2AHPGDHSD17B10
SCHEMBL23637470 0.78 ALDH1A1 (0.39) ALDH1A1KMT2ALMNAHPGDKDM4E

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