SCHEMBL5474182

SCHEMBL5474182

c1cc2ccc3cc4c5c(ccc6cc(c1)c2c3c65)c1ccc2ccc3ccc5cccc6c5c3c2c1c64

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.68
ERBB2 P04626 1/20 0.68
FYN P06241 1/20 0.68
MAOA P21397 1/20 0.68
ACHE P22303 1/20 0.68
AHR P35869 1/20 0.68
ALDH1A1 P00352 8/20 0.52
HSD17B10 Q99714 6/20 0.52
HPGD P15428 6/20 0.52
THRB P10828 1/20 0.52
TSHR P16473 3/20 0.45
CYP3A4 P08684 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
CYP1B1 Q16678 3/20 0.44
CYP1A1 P04798 2/20 0.44
KMT2A Q03164 4/20 0.38
MEN1 O00255 2/20 0.38
HIF1A Q16665 2/20 0.37
KDM4E B2RXH2 4/20 0.36

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
SCHEMBL4762106 0.96 CYP1A2 (0.68) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4855258 0.92 CYP1A2 (0.67) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4854370 0.90 CYP1A2 (0.71) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4849324 0.90 CYP1A2 (0.78) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4851816 0.90 CYP1A2 (0.60) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4856650 0.90 CYP1A2 (0.70) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4848719 0.90 CYP1A2 (0.70) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4852105 0.90 CYP1A2 (0.70) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4850514 0.90 CYP1A2 (0.69) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4848639 0.89 ALDH1A1 (0.64) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7183010-B2 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK CORPORATION (US) 2007-02-27 US disclosed
US-20040076853-A1 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2004-04-22 US disclosed