SCHEMBL12646575

SCHEMBL12646575

CCn1c(O)c(N=Nc2cc(Nc3nc(Cl)nc(Nc4ccc(S(=O)(=O)O)c(Nc5nc(N)nc(Cl)n5)c4)n3)c(S(=O)(=O)O)cc2S(=O)(=O)O)c(C)c(C(N)=O)c1=O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.38
▸ HPGDS O60760 1/20 0.36
▸ CHAT P28329 3/20 0.35
▸ USP2 O75604 1/20 0.35
▸ APEX1 P27695 1/20 0.35
▸ ENPP3 O14638 1/20 0.34
▸ ENPP1 P22413 1/20 0.34
▸ P2RX2 Q9UBL9 2/20 0.33
▸ P2RX7 Q99572 1/20 0.33
▸ P2RY2 P41231 1/20 0.32
▸ P2RY12 Q9H244 1/20 0.32
▸ CAMK2D Q13557 1/20 0.31
▸ CARM1 Q86X55 1/20 0.31
▸ PRMT1 Q99873 1/20 0.31

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
SCHEMBL12173082 1.00 FUT8 (0.38) FUT8HPGDSCHATUSP2APEX1
SCHEMBL13764095 0.92 FUT8 (0.38) FUT8HPGDSCHATUSP2APEX1
SCHEMBL12173125 0.90 FUT8 (0.35) FUT8HPGDS
SCHEMBL12589893 0.89 FUT8 (0.35) FUT8HPGDSCHATUSP2APEX1
SCHEMBL20390575 0.87 FUT8 (0.40) FUT8HPGDSCHATUSP2APEX1
SCHEMBL38654920 0.84 FUT8 (0.35) FUT8HPGDS
SCHEMBL13763511 0.83 CAMK2D (0.31) FUT8CAMK2D
SCHEMBL16373350 0.83 CARM1 (0.35) FUT8HPGDSP2RX2P2RY2P2RY12
SCHEMBL12974468 0.81 — —
SCHEMBL12974319 0.81 FUT8 (0.33) FUT8

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-7967903-B2 Ink composition EVERLIGHT USA, INC. (US) 2011-06-28 — — US disclosed
US-20090211488-A1 Inc composition EVERLIGHT USA, INC. (US) 2009-08-27 — — US disclosed
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