SCHEMBL15909773

SCHEMBL15909773

N#Cc1ccc(N(c2ccc(-c3ccc(-c4cc5ccc6cc(-c7ccccc7)cc7ccc(c4)c5c67)cc3)cc2)c2cccc3ccccc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
ABCG2 Q9UNQ0 2/20 0.39
MYC P01106 1/20 0.37
PDPK1 O15530 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36
HRH3 Q9Y5N1 3/20 0.35
SLC22A12 Q96S37 1/20 0.35
KDM1A O60341 1/20 0.35
ABCB1 P08183 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
ALDH1A3 P47895 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL15909762 1.00 CA1 (0.40) CA1CA2ABCG2MYCPDPK1
SCHEMBL15909761 0.96 CA1 (0.39) CA1CA2ABCG2MYCPDPK1
SCHEMBL15909778 0.95 HRH3 (0.37) CA1CA2ABCG2MYCPDPK1
SCHEMBL15909814 0.94 HRH3 (0.39) CA1CA2ABCG2PDPK1HRH3
SCHEMBL15909822 0.91 CA1 (0.36) CA1CA2ABCG2PDPK1HRH3
SCHEMBL15909787 0.90 CA1 (0.36) CA1CA2ABCG2MYCPDPK1
SCHEMBL15909801 0.89 PGR (0.36) CA1CA2ABCG2MYCPDPK1
SCHEMBL25544771 0.88 CA1 (0.41) CA1CA2ABCG2PDPK1SLC22A12
SCHEMBL17690906 0.88 CA1 (0.41) CA1CA2ABCG2PDPK1SLC22A12
SCHEMBL15909736 0.87 CA1 (0.43) CA1CA2ABCG2PDPK1ALDH1A1

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