SCHEMBL17246765

SCHEMBL17246765

c1ccc(-c2ccnc(-c3ccc4c5ccc(-c6ncnc(-c7ccccn7)n6)cc5c5ccccc5c4c3)n2)nc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.54
RAB9A P51151 1/20 0.54
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
KDM4E B2RXH2 5/20 0.45
TDP1 Q9NUW8 2/20 0.45
ALDH1A1 P00352 3/20 0.43
SMN1; SMN2 Q16637 4/20 0.41
LMNA P02545 3/20 0.41
TP53 P04637 3/20 0.41
CCR1 P32246 2/20 0.41
CCR5 P51681 2/20 0.41
CCR8 P51685 2/20 0.41
ALPL P05186 1/20 0.41
HSP90AA1 P07900 1/20 0.41
ALPI P09923 1/20 0.41
ALPG P10696 1/20 0.41
ALOX15 P16050 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL24353109 1.00 NPC1 (0.54) NPC1RAB9AKMT2AMEN1KDM4E
SCHEMBL17229145 0.93 KDM4E (0.52) NPC1RAB9AKMT2AMEN1KDM4E
SCHEMBL17229052 0.93 KDM4E (0.52) NPC1RAB9AKMT2AMEN1KDM4E
SCHEMBL17229049 0.92 NPC1 (0.62) NPC1RAB9AKMT2AMEN1KDM4E
SCHEMBL17229050 0.92 KDM4E (0.53) NPC1RAB9AKMT2AMEN1KDM4E
SCHEMBL17229047 0.89 KDM4E (0.47) NPC1RAB9AKMT2AMEN1KDM4E
SCHEMBL17691899 0.81 KDM4E (0.52) NPC1RAB9AKMT2AMEN1KDM4E
SCHEMBL17691901 0.81 KDM4E (0.45) NPC1RAB9AKMT2AMEN1KDM4E
SCHEMBL17691896 0.81 KDM4E (0.47) NPC1RAB9AKMT2AMEN1KDM4E
SCHEMBL16698429 0.80 NPC1 (0.59) NPC1RAB9AKMT2AMEN1KDM4E

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-10020459-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-07-10 US disclosed
US-10020459-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-07-10 US disclosed
US-20150325801-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2015-11-12 US disclosed
US-20150325801-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2015-11-12 US disclosed