SCHEMBL15909781

SCHEMBL15909781

N#Cc1ccc(N(c2ccc(-c3ccc(-c4cc5ccc6cc(-c7ccccc7)cc7ccc(c4)c5c67)cc3)cc2)c2cccnc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 7/20 0.52
CYP11B1 P15538 6/20 0.52
CYP17A1 P05093 2/20 0.52
GABRA1 P14867 1/20 0.40
GABRG2 P18507 1/20 0.40
GABRB3 P28472 1/20 0.40
GABRA5 P31644 1/20 0.40
GABRA3 P34903 1/20 0.40
NPY5R Q15761 1/20 0.40
CYP19A1 P11511 6/20 0.40
ABCG2 Q9UNQ0 2/20 0.39
MYC P01106 1/20 0.39
ABCB1 P08183 1/20 0.39
ABCC1 P33527 1/20 0.39
CYP3A4 P08684 2/20 0.37
KDM4E B2RXH2 1/20 0.37
GLA P06280 1/20 0.37
GAA P10253 1/20 0.37
ALOX5 P09917 1/20 0.36
PTGS2 P35354 1/20 0.36

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
SCHEMBL15909769 1.00 CYP11B2 (0.52) CYP11B2CYP11B1CYP17A1GABRA1GABRG2
SCHEMBL15909752 0.96 CYP11B2 (0.48) CYP11B2CYP11B1CYP17A1GABRA1GABRG2
SCHEMBL15909780 0.96 CYP11B2 (0.54) CYP11B2CYP11B1CYP17A1GABRA1GABRG2
SCHEMBL15909775 0.94 CYP11B2 (0.61) CYP11B2CYP11B1CYP17A1GABRA1GABRG2
SCHEMBL15909763 0.90 CYP11B2 (0.47) CYP11B2CYP11B1CYP17A1CYP19A1KDM4E
SCHEMBL15909779 0.90 CYP11B2 (0.47) CYP11B2CYP11B1CYP17A1CYP19A1KDM4E
SCHEMBL15909782 0.90 CYP11B2 (0.62) CYP11B2CYP11B1CYP17A1GABRA1GABRG2
SCHEMBL15909777 0.87 MYC (0.44) CYP11B2CYP11B1CYP17A1GABRA1GABRG2
SCHEMBL15909797 0.87 CYP11B2 (0.43) CYP11B2CYP11B1CYP17A1GABRA1GABRG2
SCHEMBL15909788 0.86 CYP11B2 (0.41) CYP11B2CYP11B1CYP17A1CYP19A1ABCG2

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