SCHEMBL15423182

SCHEMBL15423182

CC1(C)c2cc(-c3ccc4ncccc4c3)cc3ccc4cc(-c5nc(-c6ccccc6)cc(-c6ccccc6)n5)cc1c4c23

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.49
POLB P06746 1/20 0.49
RAB9A P51151 1/20 0.49
DYRK1A Q13627 2/20 0.45
ABCB1 P08183 1/20 0.41
ABCC1 P33527 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.41
MCL1 Q07820 1/20 0.40
ALDH1A1 P00352 2/20 0.38
ATR Q13535 1/20 0.38
PABPC1 P11940 1/20 0.38
CYP1A1 P04798 1/20 0.37
CYP1B1 Q16678 1/20 0.37
WNT1 P04628 1/20 0.37
MET P08581 3/20 0.37
MMP9 P14780 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
NTSR1 P30989 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL15423193 0.92 NPC1 (0.50) NPC1POLBRAB9ADYRK1AABCB1
SCHEMBL15423168 0.92 NPC1 (0.55) NPC1POLBRAB9ADYRK1AABCB1
SCHEMBL17343342 0.85 NPC1 (0.64) NPC1POLBRAB9ADYRK1AABCB1
SCHEMBL15423234 0.82 NPC1 (0.53) NPC1POLBRAB9ADYRK1AMCL1
SCHEMBL15423162 0.82 SMN1; SMN2 (0.39) NPC1RAB9AALDH1A1MEN1KMT2A
SCHEMBL15423173 0.81 MEN1 (0.41) NPC1RAB9AALDH1A1CYP1A1CYP1B1
SCHEMBL10051283 0.81 NPC1 (0.66) NPC1POLBRAB9ADYRK1AABCB1
SCHEMBL17945405 0.81 NPC1 (0.66) NPC1POLBRAB9ADYRK1AABCB1
SCHEMBL10051385 0.81 NPC1 (0.66) NPC1POLBRAB9ADYRK1AABCB1
SCHEMBL10051285 0.81 NPC1 (0.66) NPC1POLBRAB9ADYRK1AABCB1

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-9559310-B2 Compound with electron injection and/or electron transport capabilities and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-01-31 US disclosed
US-9559310-B2 Compound with electron injection and/or electron transport capabilities and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-01-31 US disclosed
US-20140014925-A1 NOVEL COMPOUND WITH ELECTRON INJECTION AND/OR ELECTRON TRANSPORT CAPABILITIES AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-01-16 US disclosed
US-20140014925-A1 NOVEL COMPOUND WITH ELECTRON INJECTION AND/OR ELECTRON TRANSPORT CAPABILITIES AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-01-16 US disclosed