SCHEMBL9551804

SCHEMBL9551804

O=S(=O)(O)c1cc(Nc2cc(Oc3ccc4ccccc4c3)nc(Oc3ccc4ccccc4c3)n2)ccc1C=Cc1ccc(Nc2cc(Oc3ccc4ccccc4c3)nc(Oc3ccc4ccccc4c3)n2)cc1S(=O)(=O)O.[Na].[Na]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G7 Q13093 3/20 0.38
▸ ENPP2 Q13822 2/20 0.38
▸ SNCA P37840 1/20 0.36
▸ PGR P06401 1/20 0.36
▸ KDR P35968 5/20 0.35
▸ RAD51 Q06609 1/20 0.35
▸ SUMO2 P61956 1/20 0.35
▸ SUMO1 P63165 1/20 0.35
▸ SENP7 Q9BQF6 1/20 0.35
▸ SENP3 Q9H4L4 1/20 0.35
▸ SENP2 Q9HC62 1/20 0.35
▸ SENP1 Q9P0U3 1/20 0.35
▸ PPARG P37231 1/20 0.34
▸ CTDSP1 Q9GZU7 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ GLA P06280 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ GAA P10253 1/20 0.34

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
SCHEMBL13295076 0.99 ENPP2 (0.38) PLA2G7ENPP2SNCAPGRKDR
SCHEMBL8574794 0.99 ENPP2 (0.38) PLA2G7ENPP2SNCAPGRKDR
SCHEMBL12774756 0.92 PLA2G7 (0.35) PLA2G7ENPP2SNCAPGRKDR
SCHEMBL8637932 0.92 CA1 (0.40) ENPP2SNCAPGRRAD51CTDSP1
SCHEMBL9115068 0.91 ENPP2 (0.40) ENPP2SNCAPGRKDRRAD51
SCHEMBL9115036 0.91 ENPP2 (0.40) ENPP2SNCAPGRKDRRAD51
SCHEMBL8637897 0.90 ENPP2 (0.39) ENPP2SNCAPGRKDRRAD51
SCHEMBL8985696 0.90 ENPP2 (0.39) ENPP2SNCAPGRKDRRAD51
SCHEMBL13292878 0.89 ENPP2 (0.32) PLA2G7ENPP2KDRSUMO2SUMO1
SCHEMBL8003076 0.88 RAD51 (0.47) PLA2G7PGRRAD51PPARGKDM4E

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
US-5185236-A Selectively spectrally sensitized dyes matching wavelengths of semiconductor laser beams in red-infrared; high speed, stability FUJI PHOTO FILM CO., LTD. (JP) 1993-02-09 — — US disclosed
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