SCHEMBL24969309

SCHEMBL24969309

c1ccc(-c2ccc(Nc3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3cccc(-c5ccccc5)c3-4)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 5/20 0.42
▸ MEN1 O00255 4/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ MAPT P10636 3/20 0.35
▸ AR P10275 1/20 0.35
▸ STK10 O94804 1/20 0.33
▸ SLK Q9H2G2 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ APP P05067 1/20 0.31
▸ CYP3A4 P08684 2/20 0.31
▸ HSD17B10 Q99714 2/20 0.31
▸ TSHR P16473 2/20 0.31
▸ TDP1 Q9NUW8 2/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ LMNA P02545 2/20 0.31
▸ HPGD P15428 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ GFER P55789 1/20 0.31
▸ NPSR1 Q6W5P4 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
SCHEMBL17858782 0.95 PDK2 (0.45) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL24968679 0.89 PDK2 (0.39) PDK2MEN1KMT2APOLB
SCHEMBL20435268 0.88 PDK2 (0.50) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL29634238 0.88 PDK2 (0.50) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL15003689 0.88 PDK2 (0.50) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL29638156 0.88 ALDH1A1 (0.39) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL28738480 0.88 ALDH1A1 (0.39) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL20346073 0.87 PDK2 (0.41) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL17194800 0.86 PDK2 (0.47) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL22182356 0.85 MEN1 (0.42) PDK2MEN1KMT2AALDH1A1MAPT

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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