SCHEMBL5481478

SCHEMBL5481478

c1ccc2c(c1)ccc1c2ccc2c1cc1cccc3c4cccc5cccc(c54)c2c13

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.66
FYN P06241 2/20 0.66
ACHE P22303 2/20 0.66
AHR P35869 2/20 0.66
ERBB2 P04626 1/20 0.66
MAOA P21397 1/20 0.66
ALDH1A1 P00352 6/20 0.61
HSD17B10 Q99714 5/20 0.61
HPGD P15428 3/20 0.61
THRB P10828 1/20 0.61
HPRT1 P00492 4/20 0.54
HIF1A Q16665 2/20 0.50
CYP1B1 Q16678 1/20 0.50
TSHR P16473 3/20 0.46
TDP1 Q9NUW8 3/20 0.46
CYP2A6 P11509 1/20 0.46
LCK P06239 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
MAPT P10636 1/20 0.46
SLC6A2 P23975 1/20 0.46

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
SCHEMBL1255241 0.98 CYP1A2 (0.68) CYP1A2FYNACHEAHRERBB2
SCHEMBL4853438 0.94 CYP1A2 (0.68) CYP1A2FYNACHEAHRERBB2
SCHEMBL5482455 0.94 CYP1A2 (0.67) CYP1A2FYNACHEAHRERBB2
SCHEMBL4847418 0.92 CYP1A2 (0.77) CYP1A2FYNACHEAHRERBB2
SCHEMBL4847355 0.92 CYP1A2 (0.77) CYP1A2FYNACHEAHRERBB2
SCHEMBL8321936 0.90 ALDH1A1 (0.58) CYP1A2FYNACHEAHRERBB2
SCHEMBL868423 0.90 ALDH1A1 (0.58) CYP1A2FYNACHEAHRERBB2
SCHEMBL4853519 0.90 CYP1A2 (0.81) CYP1A2FYNACHEAHRERBB2
SCHEMBL4853263 0.90 HPRT1 (0.67) CYP1A2FYNACHEAHRERBB2
SCHEMBL4657341 0.89 CYP1A2 (0.66) CYP1A2FYNACHEAHRERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7175922-B2 Aggregate organic light emitting diode devices with improved operational stability EASTMAN KODAK COMPANY (US) 2007-02-13 US claimed
US-20050106415-A1 Aggregate organic light emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2005-05-19 US claimed
WO-2005040303-A1 AGGREGATE ORGANIC LIGHT EMITTING DIODE DEVICES EASTMAN KODAK COMPANY (US) 2005-05-06 WO claimed