SCHEMBL15908649

SCHEMBL15908649

c1ccc(-c2cc(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3cccc5c6ccccc6n-4c35)cc(-c3ccccc3)n2)cc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DUSP3 P51452 1/20 0.35
PDK2 Q15119 7/20 0.34
FLT3 P36888 2/20 0.31
BMX P51813 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30
AGTR1 P30556 1/20 0.30
CYP2C19 P33261 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
ACACA Q13085 1/20 0.30
KDM4E B2RXH2 1/20 0.30
L3MBTL1 Q9Y468 1/20 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
SCHEMBL15908614 0.99 PDK2 (0.36) DUSP3PDK2FLT3BMXCYP1A2
SCHEMBL15908651 0.94 PDK2 (0.35) DUSP3PDK2FLT3BMXKDM4E
SCHEMBL15908616 0.93 PDK2 (0.37) DUSP3PDK2KDM4EL3MBTL1
SCHEMBL15908623 0.93 PDK2 (0.34) DUSP3PDK2FLT3BMXKDM4E
SCHEMBL15908653 0.92 DUSP3 (0.34) DUSP3PDK2FLT3BMXCYP1A2
SCHEMBL21867769 0.91 MEN1 (0.35) DUSP3PDK2FLT3BMXCYP1A2
SCHEMBL15908618 0.91 MEN1 (0.36) DUSP3PDK2CYP1A2CYP3A4GAA
SCHEMBL15908615 0.91 PDK2 (0.35) DUSP3PDK2FLT3BMXKDM4E
SCHEMBL15908622 0.91 MEN1 (0.36) DUSP3PDK2CYP1A2CYP3A4GAA
SCHEMBL15908652 0.91 MAPT (0.36) DUSP3FLT3BMXCYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9203033-B2 Nitrogen-containing heterocyclic compounds and organic electronic device comprising the same LG CHEM, LTD. (KR) 2015-12-01 US disclosed
US-9203033-B2 Nitrogen-containing heterocyclic compounds and organic electronic device comprising the same LG CHEM, LTD. (KR) 2015-12-01 US disclosed
US-20140209884-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND ORGANIC ELECTRONIC DEVICE COMPRISING THE SAME LG CHEM LTD. (KR) 2014-07-31 US disclosed
US-20140209884-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND ORGANIC ELECTRONIC DEVICE COMPRISING THE SAME LG CHEM LTD. (KR) 2014-07-31 US disclosed