SCHEMBL20237396

SCHEMBL20237396

[Ir].c1ccc2c(-c3nccc4ccccc34)cccc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.57
MAPT P10636 5/20 0.49
NPC1 O15118 4/20 0.49
KDM4E B2RXH2 4/20 0.49
RAB9A P51151 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
GLA P06280 1/20 0.49
KMT2A Q03164 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
PLAU P00749 2/20 0.48
CYP2A6 P11509 1/20 0.48
F12 P00748 1/20 0.48
NCF1 P14598 1/20 0.48
NOS3 P29474 1/20 0.48
NOS1 P29475 1/20 0.48
NOS2 P35228 1/20 0.48
BACE1 P56817 1/20 0.48
ALDH1A1 P00352 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
MAOA P21397 1/20 0.47

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
SCHEMBL31011155 1.00 BCHE (0.57) BCHEMAPTNPC1KDM4ERAB9A
SCHEMBL29986041 0.98 BCHE (0.58) BCHEMAPTNPC1KDM4ERAB9A
SCHEMBL158912 0.98 BCHE (0.58) BCHEMAPTNPC1KDM4ERAB9A
SCHEMBL30332586 0.96 BCHE (0.57) BCHEMAPTNPC1KDM4ERAB9A
SCHEMBL30332338 0.96 BCHE (0.57) BCHEMAPTNPC1KDM4ERAB9A
SCHEMBL27873740 0.86 BCHE (0.52) BCHEMAPTNPC1KDM4ERAB9A
SCHEMBL31303921 0.85 TNF (0.62) BCHEMAPTNPC1KDM4ERAB9A
SCHEMBL15901793 0.85 BCHE (0.57) BCHEMAPTNPC1KDM4ERAB9A
SCHEMBL24662849 0.85 BCHE (0.50) BCHEMAPTNPC1KDM4ERAB9A
SCHEMBL29923403 0.83 PLAU (0.60) BCHEMAPTNPC1KDM4ERAB9A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1348711-B1 LUMINESCENT ELEMENT AND DISPLAY CANON KK (JP) 2018-06-13 EP disclosed