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Sugi Predict / Compounds / SCHEMBL21867772

SCHEMBL21867772

SCHEMBL21867772

c1ccc(-c2cccc(-c3cc(-c4ccccc4)nc(-c4cccc(-c5ccc6c(c5)-c5ccccc5C65c6ccccc6-n6c7ccccc7c7cccc5c76)c4)n3)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.37
▸ KMT2A Q03164 4/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ MAPT P10636 3/20 0.37
▸ HPGD P15428 3/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ LMNA P02545 2/20 0.37
▸ GLA P06280 1/20 0.35
▸ DUSP3 P51452 1/20 0.31
▸ NTSR1 P30989 1/20 0.31
▸ PDK2 Q15119 3/20 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
SCHEMBL24293142 0.95 MEN1 (0.33) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL21867761 0.94 CYP1A1 (0.36) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL21867775 0.94 MEN1 (0.33) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL24293639 0.94 DUSP3 (0.33) DUSP3PDK2
SCHEMBL24293614 0.94 DUSP3 (0.33) DUSP3PDK2
SCHEMBL24905033 0.94 DUSP3 (0.33) DUSP3PDK2
SCHEMBL15908625 0.93 MEN1 (0.34) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL21868588 0.93 DUSP3 (0.33) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL24293617 0.93 MEN1 (0.34) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL21867774 0.92 MEN1 (0.34) MEN1KMT2AALDH1A1MAPTHPGD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220376178-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2022-11-24 — — US disclosed
WO-2020067823-A1 ORGANIC ELECTROLUMINESCENT ELEMENT 주식회사 엘지화학 2020-04-02 — — WO disclosed