SCHEMBL22920820

SCHEMBL22920820

c1ccc(-c2ccccc2-c2ccc(Nc3ccccc3C3(c4ccccc4)c4ccccc4-c4ccccc43)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.39
▸ KMT2A Q03164 5/20 0.39
▸ POLB P06746 1/20 0.39
▸ KDM4E B2RXH2 4/20 0.38
▸ MAPT P10636 4/20 0.38
▸ LMNA P02545 3/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ OPRK1 P41145 1/20 0.38
▸ MAPK13 O15264 1/20 0.37
▸ MAPK12 P53778 1/20 0.37
▸ MAPK11 Q15759 1/20 0.37
▸ MAPK14 Q16539 1/20 0.37
▸ PDK2 Q15119 1/20 0.35
▸ STK10 O94804 1/20 0.34
▸ SLK Q9H2G2 1/20 0.34
▸ AURKA O14965 1/20 0.34
▸ TDP1 Q9NUW8 5/20 0.33
▸ GAA P10253 2/20 0.33
▸ GLA P06280 2/20 0.33
▸ PTGS2 P35354 2/20 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
SCHEMBL20871547 0.95 MEN1 (0.40) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL22403681 0.89 MEN1 (0.43) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL21763509 0.89 MEN1 (0.36) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL26227476 0.86 MEN1 (0.46) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL24883250 0.86 MEN1 (0.41) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL25706195 0.85 NPC1 (0.49) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL25701140 0.85 MEN1 (0.40) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL24794823 0.84 MEN1 (0.38) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL24883319 0.83 MEN1 (0.46) MEN1KMT2APOLBKDM4EMAPT
SCHEMBL23696740 0.82 SIRT2 (0.46) MEN1KMT2APOLBKDM4EMAPT

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-2021015555-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME ORGANIC ELECTRIC ELEMENT 덕산네오룩스 주식회사 2021-01-28 — — WO disclosed
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