SCHEMBL17692019

SCHEMBL17692019

c1cc(-c2ccc3ccc4cc(-c5cccc(-c6cccc7cccnc67)c5)c5ccccc5c4c3c2)cc(-c2cccc3cccnc23)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.45
CCR1 P32246 5/20 0.41
CCR8 P51685 5/20 0.41
CCR5 P51681 3/20 0.41
LMNA P02545 2/20 0.41
CYP3A4 P08684 2/20 0.41
TSHR P16473 2/20 0.41
HIF1A Q16665 2/20 0.41
KDM4E B2RXH2 1/20 0.41
GMNN O75496 1/20 0.41
TP53 P04637 1/20 0.41
HSP90AA1 P07900 1/20 0.41
MMP2 P08253 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
MMP9 P14780 1/20 0.41
ALOX15 P16050 1/20 0.41
NFKB1 P19838 1/20 0.41
MMP8 P22894 1/20 0.41
THPO P40225 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
SCHEMBL17691971 0.85 MAPT (0.47) CCR1CCR8CCR5LMNACYP3A4
SCHEMBL19167173 0.85 KDM4E (0.39) BRD4CCR1CCR8CCR5LMNA
SCHEMBL22617913 0.85 NPC1 (0.39) BRD4CCR1CCR8CCR5LMNA
SCHEMBL17691947 0.84 BRD4 (0.47) BRD4CCR1CCR8CCR5LMNA
SCHEMBL17229055 0.84 BRD4 (0.51) BRD4CCR1CCR8CCR5LMNA
SCHEMBL17691988 0.83 CCR1 (0.42) BRD4CCR1CCR8CCR5LMNA
SCHEMBL17691989 0.82 CCR1 (0.50) CCR1CCR8CCR5LMNACYP3A4
SCHEMBL19168525 0.82 TOP1 (0.44) BRD4CCR1CCR8CCR5LMNA
SCHEMBL13615997 0.82 BRD4 (0.44) BRD4CCR1CCR8CCR5LMNA
SCHEMBL22618003 0.81 CYP11B1 (0.33) BRD4CCR1CCR8CCR5CYP11B1

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