SCHEMBL14020997

SCHEMBL14020997

NC(=O)Nc1cc(Nc2nc(Cl)nc(Cl)n2)ccc1N=Nc1cc2c(S(=O)(=O)O)cc(SOOO)cc2cc1S(=O)(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.38
▸ CARM1 Q86X55 1/20 0.36
▸ PRMT1 Q99873 1/20 0.36
▸ PTPN11 Q06124 1/20 0.34
▸ CHAT P28329 3/20 0.33
▸ USP2 O75604 1/20 0.33
▸ APEX1 P27695 1/20 0.33
▸ HPGDS O60760 1/20 0.33
▸ ENPP3 O14638 1/20 0.32
▸ ENPP1 P22413 1/20 0.32
▸ P2RY2 P41231 4/20 0.32
▸ P2RY12 Q9H244 4/20 0.32
▸ P2RY4 P51582 3/20 0.32
▸ P2RX2 Q9UBL9 2/20 0.32
▸ P2RY6 Q15077 2/20 0.32
▸ CA12 O43570 4/20 0.32
▸ CA1 P00915 4/20 0.32
▸ CA2 P00918 4/20 0.32
▸ CA9 Q16790 4/20 0.32
▸ CHRNA7 P36544 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
SCHEMBL14071632 1.00 FUT8 (0.38) FUT8CARM1PRMT1PTPN11CHAT
SCHEMBL13793182 0.94 FUT8 (0.38) FUT8CARM1PRMT1PTPN11CHAT
SCHEMBL12377651 0.92 FUT8 (0.38) FUT8CARM1PRMT1PTPN11CHAT
SCHEMBL12053422 0.92 FUT8 (0.38) FUT8CARM1PRMT1PTPN11CHAT
SCHEMBL14071650 0.92 FUT8 (0.34) FUT8CARM1PRMT1PTPN11CHRNA7
SCHEMBL14071657 0.91 FUT8 (0.32) FUT8CARM1PRMT1CA12CA1
SCHEMBL13793456 0.89 FUT8 (0.36) FUT8CARM1PRMT1CHATUSP2
SCHEMBL13599483 0.89 FUT8 (0.36) FUT8CARM1PRMT1CHATUSP2
SCHEMBL13604230 0.89 FUT8 (0.36) FUT8CARM1PRMT1CHATUSP2
SCHEMBL13599477 0.88 CHAT (0.36) FUT8PTPN11CHATUSP2APEX1

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-7442780-B2 light fastness, wet and dry crock resistance, perspiration, dye-transfer staining and wash fastness NORTH CAROLINA STATE UNIVERSITY (US) 2008-10-28 — — US disclosed
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