SCHEMBL4854692

SCHEMBL4854692

c1cc2cc3cc4cccc5c6cccc7cc8cc9cccc%10c(c1)c2c1c3c(c45)c(c76)c8c1c9%10

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 6/20 0.60
ERBB2 P04626 1/20 0.60
FYN P06241 1/20 0.60
MAOA P21397 1/20 0.60
ACHE P22303 1/20 0.60
AHR P35869 1/20 0.60
ALDH1A1 P00352 10/20 0.55
HSD17B10 Q99714 8/20 0.55
HPGD P15428 6/20 0.55
THRB P10828 1/20 0.55
TSHR P16473 5/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
HIF1A Q16665 2/20 0.43
MAPK1 P28482 1/20 0.43
CASP1 P29466 1/20 0.43
MEN1 O00255 1/20 0.42
DNMT1 P26358 1/20 0.42
CACNA1B Q00975 1/20 0.42
APBA1 Q02410 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL4851787 0.94 CYP1A2 (0.65) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL1978375 0.92 CYP1A2 (0.71) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4850134 0.92 CYP1A2 (0.64) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4853683 0.91 CYP1A2 (0.69) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL5476802 0.91 CYP1A2 (0.63) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4855722 0.91 CYP1A2 (0.69) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL29636233 0.89 CYP1A2 (0.67) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4846712 0.87 CYP1A2 (0.72) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4845221 0.87 CYP1A2 (0.72) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL21821355 0.87 CYP1A2 (0.72) 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