SCHEMBL8601698

SCHEMBL8601698

Cl[Zn-](Cl)Cl.c1ccc([P+](Cc2cccc3ccccc23)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
CYP1A2 P05177 3/20 0.43
CYP2C19 P33261 2/20 0.43
CYP2C9 P11712 1/20 0.43
ACP3 P15309 1/20 0.42
CYP2D6 P10635 2/20 0.41
HRH4 Q9H3N8 1/20 0.40
SIGMAR1 Q99720 2/20 0.38
SLC6A4 P31645 1/20 0.38
HIF1A Q16665 1/20 0.38
ADRA2A P08913 1/20 0.37
ADRA2B P18089 1/20 0.37
ADRA2C P18825 1/20 0.37
ADRA1D P25100 1/20 0.37
ADRA1A P35348 1/20 0.37
ADRA1B P35368 1/20 0.37

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
SCHEMBL31208285 0.93 CTNNB1 (0.49) CTNNB1TDP1CYP1A2CYP2C19CYP2C9
Bromide SCHEMBL4182972 0.91 CTNNB1 (0.47) CTNNB1TDP1CYP1A2CYP2C19CYP2C9
Hydrochloric Acid SCHEMBL723040 0.91 CTNNB1 (0.47) CTNNB1TDP1CYP1A2CYP2C19CYP2C9
SCHEMBL8372539 0.90 CTNNB1 (0.44) CTNNB1TDP1CYP1A2CYP2C19CYP2C9
SCHEMBL8379526 0.90 CTNNB1 (0.44) CTNNB1TDP1CYP1A2CYP2C19CYP2C9
SCHEMBL8374373 0.90 CTNNB1 (0.44) CTNNB1TDP1CYP1A2CYP2C19CYP2C9
SCHEMBL8379528 0.81 CTNNB1 (0.43) CTNNB1TDP1CYP1A2CYP2C19CYP2C9
SCHEMBL8605680 0.75 HIF1A (0.40) SLC6A4HIF1A
Bromide SCHEMBL9954359 0.74 HIF1A (0.48) CTNNB1TDP1CYP1A2CYP2C19CYP2C9
Bromide SCHEMBL2446627 0.72 HIF1A (0.55) CYP1A2CYP2C19CYP2D6SIGMAR1SLC6A4

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
EP-0718707-B1 Quaternary phosphonium trihalozincate salts as charge-control agents for toners and developers EASTMAN KODAK CO (US) 1998-03-04 EP disclosed
US-5561020-A THERMALLY STABLE, UNIFORMLY DISPERSIBLE EASTMAN KODAK COMPANY (US) 1996-10-01 US disclosed
EP-0718707-A1 Quaternary phosphonium trihalozincate salts as charge-control agents for toners and developers EASTMAN KODAK COMPANY (US) 1996-06-26 EP disclosed