SCHEMBL26157544

SCHEMBL26157544

CC1(C)c2ccccc2-c2ccc(-c3ccccc3Nc3cccc(-c4ccc(-c5ccc6c(c5)C(C)(C)c5ccccc5-6)c5ccccc45)c3)cc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ GLA P06280 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ PDK2 Q15119 9/20 0.34
▸ ABCG2 Q9UNQ0 4/20 0.34
▸ ABCB1 P08183 3/20 0.34
▸ ABCC1 P33527 2/20 0.34
▸ FADS1 O60427 1/20 0.34
▸ SIRT2 Q8IXJ6 1/20 0.34
▸ SIRT1 Q96EB6 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ HPGD P15428 1/20 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
SCHEMBL25125291 0.91 SIRT2 (0.40) PDK2SIRT2SIRT1
SCHEMBL25502808 0.90 CDC25B (0.37) KDM4EMEN1GLAGAAMAPT
SCHEMBL25502789 0.90 CDC25B (0.37) KDM4EMEN1GLAGAAMAPT
SCHEMBL25125137 0.88 PDK2 (0.40) PDK2
SCHEMBL14353360 0.86 EGFR (0.38) PDK2ABCG2ABCB1ABCC1ALDH1A1
SCHEMBL26157815 0.86 FABP3 (0.38) PDK2CDC25B
SCHEMBL26157679 0.85 ALDH1A1 (0.36) KDM4EMEN1GLAGAAMAPT
SCHEMBL25124813 0.85 CDC25B (0.39) MAPTABCG2ABCB1ABCC1FADS1
SCHEMBL25125292 0.85 PDK2 (0.40) PDK2
SCHEMBL21350245 0.85 PDK2 (0.43) MEN1MAPTKMT2APDK2ALDH1A1

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-2023096210-A1 COMPOUND FOR ORGANIC ELECTRICAL ELEMENT, ORGANIC ELECTRICAL ELEMENT USING SAME AND ELECTRONIC DEVICE THEREFOR 덕산네오룩스 주식회사 2023-06-01 — — WO disclosed
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