SCHEMBL15909620

SCHEMBL15909620

CC1(C)c2cccc3ccc4cc(-c5ccc(-c6ccc(N(c7ccc(C#N)cc7)c7ccc(-c8cccc9cccnc89)cc7)cc6)cc5)cc1c4c23

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP1 P07148 1/20 0.40
KDM4E B2RXH2 2/20 0.35
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
HTR2B P41595 2/20 0.33
GLO1 Q04760 1/20 0.33
PARP1 P09874 1/20 0.33
FNTA P49354 2/20 0.33
FNTB P49356 2/20 0.33
BACE1 P56817 1/20 0.33
SLC40A1 Q9NP59 1/20 0.32
PGGT1B P53609 2/20 0.32
PDK2 Q15119 1/20 0.32
EGLN1 Q9GZT9 1/20 0.32
PDE4A P27815 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL15909629 1.00 FABP1 (0.40) FABP1KDM4EHTR2AHTR2CHTR2B
SCHEMBL15909662 0.91 CYP11B2 (0.43) FABP1KDM4EPARP1FNTAFNTB
SCHEMBL15909627 0.91 KDM4E (0.36) FABP1KDM4EGLO1PARP1FNTA
SCHEMBL15909675 0.90 FABP1 (0.40) FABP1KDM4EHTR2AHTR2CHTR2B
SCHEMBL15909649 0.89 FABP1 (0.39) FABP1HTR2AHTR2CHTR2BFNTA
SCHEMBL15909665 0.84 HRH3 (0.35) PARP1PDK2
SCHEMBL17849647 0.84 MYC (0.37) KDM4EPARP1PDK2
SCHEMBL15909621 0.84 PARP1 (0.32) FABP1KDM4EPARP1PDK2
SCHEMBL15909666 0.84 CYP11B2 (0.48)
SCHEMBL15909619 0.83 TGFBR1 (0.35) PARP1ALDH1A1POLBGSK3B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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