SCHEMBL17680326

SCHEMBL17680326

c1ccc(-c2ccc3ccc4ccc(-c5cccc(-c6ccc7ccc8cccc9ccc6c7c89)c5)nc4c3n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.43
CYP1A2 P05177 3/20 0.39
ERBB2 P04626 1/20 0.39
FYN P06241 1/20 0.39
MAOA P21397 1/20 0.39
ACHE P22303 1/20 0.39
AHR P35869 1/20 0.39
PIM1 P11309 1/20 0.39
PIM2 Q9P1W9 1/20 0.39
MEN1 O00255 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP1A1 P04798 1/20 0.35
CYP1B1 Q16678 1/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 3/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
HSD17B10 Q99714 2/20 0.34
THRB P10828 1/20 0.34

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
SCHEMBL21103895 0.97 PARP1 (0.42) PARP1CYP1A2ERBB2FYNMAOA
SCHEMBL17899303 0.94 PARP1 (0.42) PARP1CYP1A2ERBB2FYNMAOA
SCHEMBL21103890 0.94 PARP1 (0.42) PARP1CYP1A2ERBB2FYNMAOA
SCHEMBL26453751 0.93 PARP1 (0.41) PARP1CYP1A2ERBB2FYNMAOA
SCHEMBL21103667 0.93 PARP1 (0.41) PARP1CYP1A2ERBB2FYNMAOA
SCHEMBL19768394 0.92 PARP1 (0.39) PARP1CYP1A2ERBB2FYNMAOA
SCHEMBL19768321 0.92 PARP1 (0.39) PARP1CYP1A2ERBB2FYNMAOA
SCHEMBL19768363 0.92 MEN1 (0.43) PARP1CYP1A2ERBB2FYNMAOA
SCHEMBL17899307 0.91 PARP1 (0.46) PARP1CYP1A2ERBB2FYNMAOA
SCHEMBL24454112 0.91 PARP1 (0.39) PARP1CYP1A2ERBB2FYNMAOA

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-9773983-B2 Organic light emitting diode device LG DISPLAY CO., LTD. (KR) 2017-09-26 US disclosed
US-9773983-B2 Organic light emitting diode device LG DISPLAY CO., LTD. (KR) 2017-09-26 US disclosed
US-20160104844-A1 ORGANIC LIGHT EMITTING DIODE DEVICE LG DISPLAY CO., LTD. (KR) 2016-04-14 US disclosed
US-20160104844-A1 ORGANIC LIGHT EMITTING DIODE DEVICE LG DISPLAY CO., LTD. (KR) 2016-04-14 US disclosed