SCHEMBL15909667

SCHEMBL15909667

CC1(C)c2cccc3ccc4cc(-c5ccc(-c6ccc(N(c7ccc(C#N)cc7)c7cccc8ccccc78)cc6)cc5)cc1c4c23

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
HRH3 Q9Y5N1 4/20 0.33
PDK2 Q15119 1/20 0.33
PDPK1 O15530 1/20 0.32
SLC6A4 P31645 1/20 0.32
ABCG2 Q9UNQ0 1/20 0.32
PIM1 P11309 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
SLC22A12 Q96S37 1/20 0.31
KDM1A O60341 1/20 0.31
MYB P10242 1/20 0.31
PGR P06401 2/20 0.31
MMP3 P08254 1/20 0.31
MYC P01106 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
SCHEMBL15909634 1.00 CA1 (0.34) CA1CA2HRH3PDK2PDPK1
SCHEMBL15909631 0.95 HRH3 (0.33) CA1CA2HRH3PDK2PDPK1
SCHEMBL15909674 0.94 HRH3 (0.37) CA1CA2HRH3PDK2PDPK1
SCHEMBL15909672 0.93 PDK2 (0.36) CA1CA2HRH3PDK2PIM1
SCHEMBL15909653 0.91 PGR (0.36) CA1CA2HRH3PDK2PDPK1
SCHEMBL15909632 0.90 CA1 (0.32) CA1CA2PDK2SLC6A4ABCG2
SCHEMBL17849677 0.90 PARP1 (0.32) PDPK1
SCHEMBL17849647 0.89 MYC (0.37) HRH3PDK2ABCG2KDM4ELMNA
SCHEMBL15909665 0.89 HRH3 (0.35) HRH3PDK2ABCG2PGRMYC
SCHEMBL17849700 0.89 SIGMAR1 (0.34)

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-9371270-B2 Compound for organic light-emitting device and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-21 US disclosed
US-9371270-B2 Compound for organic light-emitting device and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-21 US disclosed
US-20140209872-A1 COMPOUND, ORGANIC LIGHT EMITTING DEVICE INCLUDING THE COMPOUND, AND FLAT DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2014-07-31 US disclosed
US-20140209872-A1 COMPOUND, ORGANIC LIGHT EMITTING DEVICE INCLUDING THE COMPOUND, AND FLAT DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2014-07-31 US disclosed