SCHEMBL8613439

SCHEMBL8613439

CCOC(=O)CCc1ccc(-c2ccc(I)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.66
CYP4A11 Q02928 2/20 0.66
HRH3 Q9Y5N1 1/20 0.54
CYP4Z1 Q86W10 3/20 0.52
SYK P43405 4/20 0.47
TDP1 Q9NUW8 1/20 0.46
PDE3B Q13370 1/20 0.44
PDE3A Q14432 1/20 0.44
P2RY12 Q9H244 1/20 0.44
PTPN1 P18031 1/20 0.44
CYP4F11 Q9HBI6 1/20 0.44
CYP4F12 Q9HCS2 1/20 0.44
EPHX2 P34913 1/20 0.43

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
SCHEMBL4871127 0.95 CYP4F2 (0.72) CYP4F2CYP4A11HRH3CYP4Z1TDP1
SCHEMBL23512483 0.87 CYP4F2 (0.70) CYP4F2CYP4A11HRH3CYP4Z1SYK
SCHEMBL11894639 0.87 CYP4F2 (0.70) CYP4F2CYP4A11HRH3CYP4Z1SYK
SCHEMBL68902 0.86 CYP4F2 (0.85) CYP4F2CYP4A11HRH3CYP4Z1TDP1
SCHEMBL7653079 0.85 CYP4F2 (0.58) CYP4F2CYP4A11HRH3CYP4Z1TDP1
SCHEMBL2772418 0.85 CYP4F2 (0.68) CYP4F2CYP4A11HRH3CYP4Z1TDP1
SCHEMBL435053 0.85 CYP4F2 (0.68) CYP4F2CYP4A11HRH3CYP4Z1SYK
SCHEMBL7658000 0.84 CYP4Z1 (0.59) CYP4F2CYP4A11HRH3CYP4Z1TDP1
SCHEMBL10736489 0.84 CYP4F2 (0.66) CYP4F2CYP4A11HRH3CYP4Z1SYK
SCHEMBL12431331 0.83 HRH3 (0.52) CYP4F2CYP4A11HRH3PTPN1EPHX2

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-5817739-A POLYESTER; SOLUBILITY; FILM FORMING PROPERTIES; IONIZING POTENTIAL CONTROL FUJI XEROX CO., LTD. (JP) 1998-10-06 US disclosed
US-5736285-A PHOTOSENSITIVE LAYER CONTAINS CHARGE TRANSPORTING POLYESTER AND ATLEAST ONE BISAZO PIGMENT; WEAR RESISTANCE AND ELECTRIC STABILITY FUJI XEROX CO., LTD. (JP) 1998-04-07 US disclosed
US-5731118-A Charge transporting random copolyester resin, process for producing the same and organic electronic device using the same FUJI XEROX CO., LTD. (JP) 1998-03-24 US disclosed