SCHEMBL21867769

SCHEMBL21867769

c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4cccc6c7ccccc7n-5c46)c3)n2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.35
KMT2A Q03164 5/20 0.35
MAPT P10636 5/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 3/20 0.35
LMNA P02545 3/20 0.35
KDM4E B2RXH2 2/20 0.35
NTSR1 P30989 1/20 0.34
DUSP3 P51452 1/20 0.34
GLA P06280 1/20 0.33
CYP1A2 P05177 2/20 0.32
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
CYP3A4 P08684 1/20 0.32
GAA P10253 1/20 0.32
AGTR1 P30556 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
MAPK10 P53779 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL15908652 0.98 MAPT (0.36) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL15908618 0.96 MEN1 (0.36) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL15908622 0.96 MEN1 (0.36) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL24905628 0.95 FLT3 (0.34) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL21394448 0.95 DUSP3 (0.34) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL15908656 0.95 MEN1 (0.39) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL15908625 0.94 MEN1 (0.34) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL21394450 0.94 DUSP3 (0.34) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL21394457 0.94 DUSP3 (0.34) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL21394456 0.94 DUSP3 (0.34) MEN1KMT2AMAPTALDH1A1HPGD

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