SCHEMBL17692007

SCHEMBL17692007

c1ccc(-c2ccc3c(ccc4cc(-c5cccc6ncoc56)c5ccccc5c43)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.40
CYP1A2 P05177 2/20 0.35
ERBB2 P04626 1/20 0.35
FYN P06241 1/20 0.35
MAOA P21397 1/20 0.35
ACHE P22303 1/20 0.35
AHR P35869 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
CASP1 P29466 1/20 0.35
HIF1A Q16665 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KCNA3 P22001 1/20 0.34
GPR84 Q9NQS5 4/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL17691993 0.93 ACLY (0.40) ACLYCYP1A2ERBB2FYNMAOA
SCHEMBL17691829 0.89 ACLY (0.43) ACLYCYP1A2KCNA3GPR84ERN1
SCHEMBL17691816 0.86 ACLY (0.45) ACLYCYP1A2KCNA3GPR84ERN1
SCHEMBL20698381 0.85 ACLY (0.32) ACLYKCNA3
SCHEMBL17231483 0.83 ACLY (0.45) ACLYALDH1A1HPGDTSHRMAPK1
SCHEMBL17691865 0.80 ERN1 (0.40) ACLYCYP1A2ERBB2FYNMAOA
SCHEMBL17691839 0.79 ERN1 (0.40) ACLYKCNA3GPR84ERN1HSD17B1
SCHEMBL17231484 0.79 ACLY (0.47) ACLYKCNA3JAK2JAK1TYK2
SCHEMBL9195385 0.78 BACE1 (0.49) ACLYCYP1A2KCNA3GPR84HSD17B1
SCHEMBL17692150 0.77 ACLY (0.42) ACLYCYP1A2ALDH1A1HPGDTSHR

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-10826000-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2020-11-03 US disclosed
US-20190036043-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2019-01-31 US disclosed
US-20160111664-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-04-21 US disclosed
US-20160111664-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-04-21 US disclosed