SCHEMBL8604649

SCHEMBL8604649

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.48
GRIK1 P39086 1/20 0.41
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 1/20 0.39
SIGMAR1 Q99720 1/20 0.38
MAOA P21397 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
KCNH2 Q12809 1/20 0.38
MAOB P27338 1/20 0.37
HTR2A P28223 1/20 0.37
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
HDAC3 O15379 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
HDAC2 Q92769 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
Bromide SCHEMBL1098 0.87 HIF1A (0.58) HIF1AGRIK1ALDH1A1CYP1A2CYP2D6
SCHEMBL8377196 0.86 HIF1A (0.48) HIF1AGRIK1ALDH1A1CYP1A2CYP2D6
SCHEMBL8371256 0.86 HIF1A (0.48) HIF1AGRIK1ALDH1A1CYP1A2CYP2D6
SCHEMBL8376791 0.85 HIF1A (0.52) HIF1AGRIK1ALDH1A1CYP1A2CYP2D6
Iodide SCHEMBL3361577 0.81 HIF1A (0.56) HIF1ASIGMAR1MAOAMAOB
Bromide SCHEMBL3042031 0.81 HIF1A (0.56) HIF1AALDH1A1CYP1A2CYP2D6TSHR
Bromide SCHEMBL10996214 0.79 HIF1A (0.54) HIF1ASIGMAR1MAOAMAOB
Bromide SCHEMBL9442232 0.79 HIF1A (0.54) HIF1ASIGMAR1MAOAMAOB
Bromide SCHEMBL15766394 0.79 HIF1A (0.54) HIF1ASIGMAR1MAOAMAOB
Hydrochloric Acid SCHEMBL30859404 0.79 HIF1A (0.54) HIF1ASIGMAR1MAOAMAOB

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