SCHEMBL17880391

SCHEMBL17880391

Brc1cc(-c2ccc(-c3ccccc3)cn2)cc(-c2ccc3ccc4cccc5ccc2c3c45)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BIRC5 O15392 1/20 0.36
HSD17B1 P14061 1/20 0.36
HSD17B2 P37059 1/20 0.36
MET P08581 1/20 0.36
GUSB P08236 2/20 0.35
NPC1 O15118 1/20 0.35
NFKB1 P19838 1/20 0.35
RAB9A P51151 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
IDO1 P14902 2/20 0.34
TDO2 P48775 1/20 0.34
ERBB2 P04626 1/20 0.33
CYP1A2 P05177 1/20 0.33
FYN P06241 1/20 0.33
MAOA P21397 1/20 0.33
ACHE P22303 1/20 0.33
AHR P35869 1/20 0.33
ADORA2A P29274 1/20 0.32

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
SCHEMBL17680293 0.86 HPGDS (0.39) HSD17B1HSD17B2METNPC1RAB9A
SCHEMBL18116636 0.86 CYP1A2 (0.41) BIRC5HSD17B1HSD17B2GUSBERBB2
SCHEMBL17680291 0.85 IDO1 (0.43) HSD17B1HSD17B2METNPC1RAB9A
SCHEMBL17880385 0.85 CYP1A2 (0.42) BIRC5HSD17B1HSD17B2METGUSB
SCHEMBL17880383 0.84 MET (0.35) HSD17B1HSD17B2METIDO1TDO2
SCHEMBL17880396 0.84 MEN1 (0.43) BIRC5GUSBRAB9AIDO1TDO2
SCHEMBL13682472 0.83 HSD17B1 (0.49) HSD17B1HSD17B2METGUSBIDO1
SCHEMBL17880394 0.83 GUSB (0.37) BIRC5GUSBIDO1TDO2ERBB2
SCHEMBL18116637 0.83 CYP1A2 (0.41) BIRC5HSD17B1HSD17B2METGUSB
SCHEMBL17680290 0.83 IDO1 (0.44) HSD17B1HSD17B2METNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160190516-A1 ORGANIC LIGHT EMITTING DEVICE INCLUDING LIGHT-EFFICIENCY IMPROVEMENT LAYER SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 US disclosed
US-20160190516-A1 ORGANIC LIGHT EMITTING DEVICE INCLUDING LIGHT-EFFICIENCY IMPROVEMENT LAYER SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 US disclosed