SCHEMBL5480086

SCHEMBL5480086

c1ccc2c(c1)c1ccccc1c1c2ccc2c1cc1cccc3c4cccc5cccc(c54)c2c13

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.60
HSD17B10 Q99714 7/20 0.60
HPGD P15428 5/20 0.60
CYP1A2 P05177 4/20 0.60
THRB P10828 1/20 0.60
FYN P06241 2/20 0.59
ACHE P22303 2/20 0.59
AHR P35869 2/20 0.59
ERBB2 P04626 1/20 0.59
MAOA P21397 1/20 0.59
HPRT1 P00492 3/20 0.41
TSHR P16473 5/20 0.39
HIF1A Q16665 3/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
MAPK1 P28482 3/20 0.39
CASP1 P29466 2/20 0.39
CYP1B1 Q16678 2/20 0.38
CYP3A4 P08684 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
TP53 P04637 1/20 0.35

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
SCHEMBL416893 1.00 ALDH1A1 (0.60) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL4852527 0.94 ALDH1A1 (0.62) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL11212018 0.94 ALDH1A1 (0.62) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL4850496 0.92 CYP1A2 (0.70) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL4847347 0.92 CYP1A2 (0.70) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL5466666 0.91 ALDH1A1 (0.56) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL27576080 0.90 CYP1A2 (0.62) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL4846707 0.90 CYP1A2 (0.62) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL4846724 0.88 CYP1A2 (0.60) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL5481478 0.88 CYP1A2 (0.66) ALDH1A1HSD17B10HPGDCYP1A2THRB

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