SCHEMBL24969306

SCHEMBL24969306

CC1(C)c2ccc(-c3ccc(-c4ccccc4)cc3)cc2-c2cccc(Nc3ccc4c5ccccc5c5ccccc5c4c3)c21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 1/20 0.34
▸ SIRT1 Q96EB6 1/20 0.34
▸ ALK Q9UM73 1/20 0.34
▸ MAPK8 P45983 4/20 0.34
▸ MAPK10 P53779 4/20 0.34
▸ MAPK14 Q16539 4/20 0.34
▸ EPHX2 P34913 2/20 0.34
▸ TGFBR1 P36897 3/20 0.33
▸ RIPK2 O43353 2/20 0.33
▸ EGFR P00533 2/20 0.33
▸ KDR P35968 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ MAPKAPK2 P49137 1/20 0.32

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
SCHEMBL24969183 0.90 PTGER4 (0.37) SIRT2SIRT1ALKMAPK14EGFR
SCHEMBL24969191 0.83 PDK2 (0.39) SIRT2SIRT1RARARARBRARG
SCHEMBL24969713 0.83 PDK2 (0.39) SIRT2SIRT1RARARARBRARG
SCHEMBL16383445 0.81 SIRT2 (0.46) SIRT2SIRT1ALKEPHX2EGFR
SCHEMBL30076012 0.81 AKR1C3 (0.39) SIRT2SIRT1ALKMAPK14KDM4E
SCHEMBL15892495 0.81 AKR1C3 (0.39) SIRT2SIRT1ALKMAPK14KDM4E
SCHEMBL24969186 0.80 PDK2 (0.40) SIRT2SIRT1ALKMAPK14MAPKAPK2
SCHEMBL19597685 0.78 ALK (0.31) ALKTGFBR1RIPK2EGFRKDR
SCHEMBL23648311 0.78 PDK2 (0.38) KDM4EMAPT
SCHEMBL29771334 0.78 PDK2 (0.38) KDM4EMAPT

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-2023003234-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-01-26 — — WO disclosed
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