SCHEMBL17944482

SCHEMBL17944482

c1cc(-c2ccc3ccccc3c2)cc(-c2c3ccccc3c(-c3ccc4oc5ccc6c7ccccc7oc6c5c4c3)c3ccccc23)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.39
PLA2G4A P47712 3/20 0.39
PLA2G10 O15496 1/20 0.39
ALOX5 P09917 2/20 0.38
CYP1A1 P04798 2/20 0.37
CYP1B1 Q16678 1/20 0.37
NPC1 O15118 3/20 0.37
CYP1A2 P05177 2/20 0.37
RAB9A P51151 2/20 0.37
CASP3 P42574 2/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
HSD17B1 P14061 1/20 0.36
HSD17B2 P37059 1/20 0.36
HCRTR1 O43613 1/20 0.34
ANO1 Q5XXA6 1/20 0.34
MAPT P10636 3/20 0.33
AHR P35869 2/20 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
SCHEMBL17944128 1.00 PLA2G2A (0.39) PLA2G2APLA2G4APLA2G10ALOX5CYP1A1
SCHEMBL24341628 0.95 PLA2G2A (0.38) PLA2G2APLA2G4APLA2G10ALOX5CYP1A1
SCHEMBL17944130 0.95 PLA2G2A (0.39) PLA2G2APLA2G4APLA2G10ALOX5CYP1A1
SCHEMBL17932102 0.95 PLA2G2A (0.39) PLA2G2APLA2G4APLA2G10ALOX5CYP1A1
SCHEMBL17945564 0.95 CYP1A1 (0.40) ALOX5CYP1A1CYP1B1NPC1CYP1A2
SCHEMBL17932112 0.94 HCRTR1 (0.39) PLA2G2APLA2G4APLA2G10ALOX5CYP1A1
SCHEMBL17944511 0.94 HCRTR1 (0.39) PLA2G2APLA2G4APLA2G10ALOX5CYP1A1
SCHEMBL17944484 0.94 HCRTR1 (0.39) PLA2G2APLA2G4APLA2G10ALOX5CYP1A1
SCHEMBL17945050 0.94 CYP1A1 (0.38) PLA2G2APLA2G4AALOX5CYP1A1CYP1B1
SCHEMBL17932166 0.93 PLA2G2A (0.39) PLA2G2APLA2G4APLA2G10ALOX5CYP1A1

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-20160218297-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-28 US disclosed
US-20160218297-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-28 US disclosed