SCHEMBL17481723

SCHEMBL17481723

O=S(=O)(O)c1cc(Nc2nc(Cl)nc(Nc3ccc(Nc4cc(Cl)cc(Nc5cccc6cc(S(=O)(=O)O)c(N=Nc7ccc8ccccc8c7S(=O)(=O)O)c(O)c56)c4)cc3)n2)c2c(O)c(/N=N/c3ccc4c(S(=O)(=O)O)cccc4c3)c(S(=O)(=O)O)cc2c1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.63
▸ CYP1A2 P05177 3/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ DNASE1L3 Q13609 1/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ THRB P10828 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ ENPP2 Q13822 9/20 0.40
▸ ALDH1A1 P00352 2/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ CD40 P25942 1/20 0.37
▸ CD40LG P29965 1/20 0.37
▸ PHLPP2 Q6ZVD8 2/20 0.36
▸ TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL17484228 0.91 FUT8 (0.70) FUT8CYP1A2MAPK1CYP2C9DNASE1L3
SCHEMBL13455170 0.86 FUT8 (0.77) FUT8CYP1A2MAPK1CYP2C9DNASE1L3
SCHEMBL12442261 0.84 FUT8 (0.65) FUT8CYP1A2MAPK1CYP2C9DNASE1L3
SCHEMBL8115691 0.84 FUT8 (0.70) FUT8CYP1A2MAPK1CYP2C9DNASE1L3
SCHEMBL8115709 0.84 FUT8 (0.70) FUT8CYP1A2MAPK1CYP2C9DNASE1L3
SCHEMBL12138276 0.83 FUT8 (0.69) FUT8CYP1A2MAPK1CYP2C9DNASE1L3
SCHEMBL18218275 0.82 FUT8 (0.66) FUT8CYP1A2MAPK1CYP2C9DNASE1L3
SCHEMBL8974959 0.81 FUT8 (0.69) FUT8CYP1A2MAPK1CYP2C9DNASE1L3
SCHEMBL20390572 0.81 FUT8 (0.81) FUT8CYP1A2MAPK1CYP2C9DNASE1L3
SCHEMBL19754268 0.81 FUT8 (0.69) FUT8CYP1A2MAPK1CYP2C9DNASE1L3

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-20160032125-A1 INK SET SEIKO EPSON CORPORATION (JP) 2016-02-04 — — US disclosed
Send feedback