SCHEMBL15909792

SCHEMBL15909792

CC1(C)c2cc(-c3cc4ccc5cc(-c6ccccc6)cc6ccc(c3)c4c56)ccc2-c2ccc(N(c3ccc(C#N)cc3)c3cccc4ccccc34)cc21

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.36
PGR P06401 3/20 0.36
ABCG2 Q9UNQ0 2/20 0.33
HRH3 Q9Y5N1 4/20 0.32
MYC P01106 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
PIM1 P11309 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
SLC22A12 Q96S37 1/20 0.31
KDM1A O60341 1/20 0.31
PDPK1 O15530 1/20 0.30
CYP19A1 P11511 1/20 0.30
KCNH2 Q12809 1/20 0.30
ABCB1 P08183 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
SCHEMBL15909816 0.94 PDK2 (0.41) PDK2PGRHRH3CA1CA2
SCHEMBL15909672 0.92 PDK2 (0.36) PDK2PGRHRH3CA1CA2
SCHEMBL15909674 0.88 HRH3 (0.37) PDK2PGRABCG2HRH3CA1
SCHEMBL15909778 0.87 HRH3 (0.37) PGRABCG2HRH3MYCCA1
SCHEMBL15909773 0.87 CA1 (0.40) PGRABCG2HRH3MYCCA1
SCHEMBL15909762 0.87 CA1 (0.40) PGRABCG2HRH3MYCCA1
SCHEMBL10034435 0.86 LPL (0.34) PDK2PGRCA1CA2PIM1
SCHEMBL16366330 0.86 LPL (0.34) PDK2PGRCA1CA2PIM1
SCHEMBL16366593 0.86 LPL (0.34) PDK2PGRCA1CA2PIM1
SCHEMBL17153708 0.86 PDK2 (0.35) PDK2PGRCA1CA2

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-9997713-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-06-12 US disclosed
US-9997713-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-06-12 US disclosed
US-20140209875-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2014-07-31 US disclosed
US-20140209875-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2014-07-31 US disclosed