SCHEMBL14565778

SCHEMBL14565778

COc1cc(N=Nc2cccc(SOOO)c2)ccc1NNc1ccc(N=Nc2c(SOOO)cc3ccc(Nc4cccc(S(=O)(=O)O)c4)cc3c2O)cc1C

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 10/20 0.38
▸ PTPN11 Q06124 2/20 0.34
▸ GAA P10253 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ PHLPP2 Q6ZVD8 1/20 0.34
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ NSD2 O96028 1/20 0.32
▸ DUSP3 P51452 1/20 0.32
▸ PTPN5 P54829 1/20 0.32
▸ CASP7 P55210 1/20 0.32
▸ CASP6 P55212 1/20 0.32
▸ GLO1 Q04760 1/20 0.30

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
SCHEMBL13860889 0.90 ENPP2 (0.45) ENPP2PTPN11GAAMAPTMAPK1
SCHEMBL14580879 0.85 ENPP2 (0.49) ENPP2PTPN11GAAMAPTMAPK1
SCHEMBL13991866 0.83 ENPP2 (0.46) ENPP2PTPN11GAAMAPTMAPK1
SCHEMBL13860859 0.77 ENPP2 (0.45) ENPP2PTPN11PHLPP2
SCHEMBL13615187 0.75 ENPP2 (0.43) ENPP2PTPN11KMT2ATDP1PHLPP2
SCHEMBL13860883 0.74 ENPP2 (0.37) ENPP2PTPN11MAPTMAPK1KMT2A
SCHEMBL13860890 0.74 PHLPP2 (0.43) ENPP2PTPN11MAPTMAPK1KMT2A
SCHEMBL12925203 0.74 ENPP2 (0.57) ENPP2GAAMAPTMAPK1KMT2A
SCHEMBL14029011 0.73 ENPP2 (0.43) ENPP2PTPN11MAPTMAPK1KMT2A
SCHEMBL13286618 0.73 ENPP2 (0.43) ENPP2PTPN11MAPTMAPK1KMT2A

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-7192475-B2 colored materials having good hue, excellent fastness to light and active gases in the circumstance, particularly an ozone gas, and high printing density FUJI PHOTO FILM CO., LTD. (JP) 2007-03-20 — — US disclosed
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