SCHEMBL15909797

SCHEMBL15909797

CC1(C)c2cc(-c3cc4ccc5cc(-c6ccccc6)cc6ccc(c3)c4c56)ccc2-c2ccc(N(c3ccc(C#N)cc3)c3cccnc3)cc21

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 7/20 0.43
CYP11B1 P15538 6/20 0.43
CYP17A1 P05093 2/20 0.43
PDK2 Q15119 3/20 0.37
CYP19A1 P11511 3/20 0.34
GABRA1 P14867 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA5 P31644 1/20 0.34
GABRA3 P34903 1/20 0.34
KDM4E B2RXH2 1/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
PGR P06401 1/20 0.33
MYC P01106 1/20 0.33
FLT3 P36888 1/20 0.32
ABCG2 Q9UNQ0 1/20 0.32
NPY5R Q15761 1/20 0.32
GBA1 P04062 1/20 0.32

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
SCHEMBL15909800 0.95 CYP11B2 (0.48) CYP11B2CYP11B1CYP17A1PDK2CYP19A1
SCHEMBL15909796 0.93 PDK2 (0.39) CYP11B2CYP11B1CYP17A1PDK2CYP19A1
SCHEMBL15909639 0.90 CYP11B2 (0.39) CYP11B2CYP11B1CYP17A1PDK2PGR
SCHEMBL15909793 0.89 CYP11B2 (0.43) CYP11B2CYP11B1CYP17A1PDK2CYP19A1
SCHEMBL15909645 0.87 CYP11B2 (0.45) CYP11B2CYP11B1CYP17A1PDK2CYP19A1
SCHEMBL15909664 0.87 CYP11B2 (0.50) CYP11B2CYP11B1CYP17A1CYP19A1GABRA1
SCHEMBL15909817 0.87 PDK2 (0.42) CYP11B2CYP11B1CYP17A1PDK2CYP19A1
SCHEMBL15909780 0.87 CYP11B2 (0.54) CYP11B2CYP11B1CYP17A1CYP19A1GABRA1
SCHEMBL15909781 0.87 CYP11B2 (0.52) CYP11B2CYP11B1CYP17A1CYP19A1GABRA1
SCHEMBL15909769 0.87 CYP11B2 (0.52) CYP11B2CYP11B1CYP17A1CYP19A1GABRA1

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