SCHEMBL15423175

SCHEMBL15423175

CC1(C)c2cc(-c3cnc4cc(-c5cccnc5)ccc4c3)cc3ccc4cc(-c5ccccn5)cc1c4c23

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 0.49
PDGFRB P09619 2/20 0.44
PDGFRA P16234 2/20 0.44
EGFR P00533 1/20 0.44
CYP11B2 P19099 8/20 0.43
CYP11B1 P15538 7/20 0.43
CYP19A1 P11511 5/20 0.43
CYP17A1 P05093 4/20 0.43
GAK O14976 1/20 0.39
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
TP53 P04637 1/20 0.37
PKM P14618 1/20 0.37
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GRM5 P41594 1/20 0.37
PIM1 P11309 2/20 0.36
PIM2 Q9P1W9 1/20 0.36
KDM4E B2RXH2 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL15423226 0.88 CYP2A6 (0.47) CYP2A6PDGFRBPDGFRAEGFRCYP11B2
SCHEMBL15424275 0.85 CYP2A6 (0.51) CYP2A6PDGFRBPDGFRAEGFRCYP11B2
SCHEMBL15423172 0.80 ABL1 (0.42) CYP2A6CYP11B2CYP11B1CYP19A1CYP17A1
SCHEMBL15423166 0.79 CYP19A1 (0.55) CYP2A6CYP11B2CYP11B1CYP19A1CYP17A1
SCHEMBL15423161 0.79 TGFBR1 (0.41) CYP2A6PDGFRBPDGFRANPC1RAB9A
SCHEMBL15423177 0.79 SMN1; SMN2 (0.41) CYP2A6NPC1RAB9ATP53PKM
SCHEMBL15316877 0.79 CYP2A6 (0.40) CYP2A6PDGFRBPDGFRAEGFRCYP11B2
SCHEMBL15423165 0.78 CYP2A6 (0.43) CYP2A6CYP19A1NPC1RAB9ATP53
SCHEMBL15423173 0.77 MEN1 (0.41) NPC1RAB9ATP53PKMTSHR
SCHEMBL26560441 0.77 CYP2A6 (0.71) CYP2A6PDGFRBPDGFRAEGFRCYP11B2

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