SCHEMBL17229083

SCHEMBL17229083

c1cnc2ccc(-c3cc(-c4ccc5ncccc5c4)cc(-c4ccc5ccc6ccccc6c5c4)c3)cc2c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.68
RAB9A P51151 2/20 0.68
POLB P06746 1/20 0.68
CYP3A4 P08684 1/20 0.61
DYRK1A Q13627 1/20 0.59
MCL1 Q07820 1/20 0.48
GRM4 Q14833 1/20 0.47
ALDH1A1 P00352 4/20 0.46
MAPT P10636 3/20 0.46
KDM4E B2RXH2 2/20 0.46
HSD17B10 Q99714 2/20 0.46
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
TP53 P04637 1/20 0.46
HSP90AA1 P07900 1/20 0.46
HSP90AB1 P08238 1/20 0.46
TSHR P16473 1/20 0.46
CASP1 P29466 1/20 0.46
HTT P42858 1/20 0.46
ATM Q13315 1/20 0.46

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
SCHEMBL17691934 0.94 NPC1 (0.68) NPC1RAB9APOLBCYP3A4DYRK1A
SCHEMBL17691841 0.90 NPC1 (0.72) NPC1RAB9APOLBCYP3A4DYRK1A
SCHEMBL17692060 0.89 POLB (0.62) NPC1RAB9APOLBCYP3A4DYRK1A
SCHEMBL17231551 0.89 NPC1 (0.70) NPC1RAB9APOLBCYP3A4DYRK1A
SCHEMBL17691860 0.87 CYP3A4 (0.71) NPC1RAB9APOLBCYP3A4DYRK1A
SCHEMBL17229030 0.85 NPC1 (0.75) NPC1RAB9APOLBCYP3A4DYRK1A
SCHEMBL17343931 0.85 NPC1 (0.75) NPC1RAB9APOLBCYP3A4DYRK1A
SCHEMBL17691955 0.84 CYP3A4 (0.56) NPC1RAB9APOLBCYP3A4DYRK1A
SCHEMBL17229051 0.84 NPC1 (0.68) NPC1RAB9APOLBCYP3A4DYRK1A
SCHEMBL17691948 0.84 POLB (0.58) NPC1RAB9APOLBCYP3A4DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170148999-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD (KR) 2017-05-25 US disclosed
US-20170148999-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD (KR) 2017-05-25 US disclosed
US-9564598-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-07 US disclosed
US-9564598-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-07 US disclosed
US-20150318510-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD (KR) 2015-11-05 US disclosed
US-20150318510-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD (KR) 2015-11-05 US disclosed