SCHEMBL15909663

SCHEMBL15909663

CC1(C)c2cc(-c3ccc(N(c4ccccc4)c4ccc(C#N)cc4)cc3)cc3ccc4cc(-c5ccc6c(c5)sc5ccccc56)cc1c4c23

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.34
PRSS12 P56730 1/20 0.34
LIMK1 P53667 1/20 0.33
HRH3 Q9Y5N1 5/20 0.33
ABCG2 Q9UNQ0 1/20 0.32
ALOX5 P09917 1/20 0.31
PTGS2 P35354 1/20 0.31
KDM1A O60341 1/20 0.31
PDK2 Q15119 1/20 0.31
SCN9A Q15858 1/20 0.31
PIM1 P11309 1/20 0.31
PIM3 Q86V86 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
APP P05067 1/20 0.30
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
SCHEMBL15909658 0.91 LIMK1 (0.32) PRSS12LIMK1HRH3
SCHEMBL15909669 0.86 LIMK1 (0.34) LIMK1
SCHEMBL15909652 0.86 MYC (0.39) PTGDR2HRH3ABCG2PDK2SCN9A
SCHEMBL15909641 0.85 LIMK1 (0.32) LIMK1HRH3
SCHEMBL16168895 0.84 MAPT (0.40) LIMK1ALOX5
SCHEMBL16168886 0.82 MAPT (0.41) ALOX5
SCHEMBL15909646 0.82 PTGDR2 (0.45) PTGDR2HRH3KDM1APDK2SCN9A
SCHEMBL15909665 0.82 HRH3 (0.35) PTGDR2HRH3ABCG2ALOX5PTGS2
SCHEMBL17849647 0.80 MYC (0.37) PTGDR2HRH3ABCG2PDK2SCN9A
SCHEMBL17849668 0.80 HRH3 (0.37) PTGDR2HRH3ABCG2PDK2SCN9A

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