SCHEMBL4846493

SCHEMBL4846493

c1ccc2c(c1)cc1ccc3cc4cccc5c6cccc7ccc8c2c1c3c(c45)c8c76

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.71
ERBB2 P04626 1/20 0.71
FYN P06241 1/20 0.71
MAOA P21397 1/20 0.71
ACHE P22303 1/20 0.71
AHR P35869 1/20 0.71
HSD17B10 Q99714 8/20 0.56
ALDH1A1 P00352 7/20 0.56
HPGD P15428 6/20 0.56
THRB P10828 1/20 0.56
TSHR P16473 5/20 0.41
L3MBTL1 Q9Y468 4/20 0.41
HIF1A Q16665 3/20 0.41
MAPK1 P28482 2/20 0.41
CASP1 P29466 2/20 0.41
NQO2 P16083 2/20 0.40
CYP1B1 Q16678 2/20 0.40
CES1 P23141 1/20 0.40
CYP3A4 P08684 3/20 0.39
TDP1 Q9NUW8 2/20 0.39

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
SCHEMBL4855283 0.98 CYP1A2 (0.69) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4851973 0.98 CYP1A2 (0.74) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4847434 0.96 CYP1A2 (0.71) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4854612 0.94 CYP1A2 (0.63) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4845372 0.94 CYP1A2 (0.81) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4854697 0.94 CYP1A2 (0.68) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4853967 0.94 CYP1A2 (0.81) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4852627 0.94 CYP1A2 (0.68) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4848619 0.94 CYP1A2 (0.61) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4854370 0.92 CYP1A2 (0.71) CYP1A2ERBB2FYNMAOAACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7470290-B2 Hydroscopic polymer gels for easier cleaning THE CLOROX COMPANY (US) 2008-12-30 US disclosed
US-7183010-B2 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK CORPORATION (US) 2007-02-27 US disclosed
US-7175922-B2 Aggregate organic light emitting diode devices with improved operational stability EASTMAN KODAK COMPANY (US) 2007-02-13 US disclosed
US-20050245428-A1 Hydroscopic polymer gels for easier cleaning RODRIGUES KLIN A 2005-11-03 US disclosed
US-20050106415-A1 Aggregate organic light emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2005-05-19 US disclosed
WO-2005040303-A1 AGGREGATE ORGANIC LIGHT EMITTING DIODE DEVICES EASTMAN KODAK COMPANY (US) 2005-05-06 WO disclosed
US-20040076853-A1 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2004-04-22 US disclosed