SCHEMBL6536972

SCHEMBL6536972

CSC(=N)N.Cl[Ir](Cl)(Cl)(Cl)Cl

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 6/20 0.73
NOS3 P29474 5/20 0.73
NOS2 P35228 5/20 0.73
MAPK1 P28482 1/20 0.73
CYP2D6 P10635 2/20 0.55
CYP2C19 P33261 2/20 0.55
BLM P54132 2/20 0.55
KDM4E B2RXH2 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
CYP1A2 P05177 2/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
HRH4 Q9H3N8 2/20 0.33

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
SCHEMBL78077 0.86
Hydrochloric Acid SCHEMBL4633139 0.82
Bromide SCHEMBL10831404 0.82
Iodide SCHEMBL916721 0.82
Iodide SCHEMBL11696034 0.79
Cyanide SCHEMBL9499405 0.76
Sulfurous Acid SCHEMBL25206600 0.71
Sulfuric Acid SCHEMBL18206 0.71 BLM (1.00) NOS1NOS3NOS2MAPK1CYP2D6
Sulfuric Acid SCHEMBL22347074 0.71 BLM (1.00) NOS1NOS3NOS2MAPK1CYP2D6
Sulfuric Acid SCHEMBL317855 0.71 BLM (1.00) NOS1NOS3NOS2MAPK1CYP2D6

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-6808870-B2 METAL COMPLEX HAVING IN A LIGAND A SITE WHICH CAN FORM A BOND WITH A SILVER ION FUJI PHOTO FILM CO., LTD. (JP) 2004-10-26 US disclosed
US-20030194664-A1 Light-sensitive silver halide grain and silver halide emulsion FUJI PHOTO FILM CO., LTD. 2003-10-16 US disclosed