SCHEMBL20685319

SCHEMBL20685319

Nc1nc(Cl)nc(Nc2cc(Nc3nc(Cl)nc(Nc4ccc(S(=O)(=O)O)c(N=Nc5c(S(=O)(=O)O)cc6cc(S(=O)(=O)O)c(/N=N\c7cc(S(=O)(=O)O)ccc7S(=O)(=O)O)c(N)c6c5O)c4)n3)ccc2S)n1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.57
▸ CHAT P28329 4/20 0.40
▸ USP2 O75604 1/20 0.40
▸ APEX1 P27695 1/20 0.40
▸ PRMT1 Q99873 2/20 0.40
▸ CYP1A2 P05177 2/20 0.40
▸ ENPP3 O14638 1/20 0.39
▸ ENPP1 P22413 1/20 0.39
▸ ENPP2 Q13822 6/20 0.38
▸ MEN1 O00255 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ CARM1 Q86X55 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ DNASE1L3 Q13609 1/20 0.36
▸ HPGDS O60760 1/20 0.35
▸ THRB P10828 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
SCHEMBL20685317 0.94 FUT8 (0.60) FUT8CHATUSP2APEX1PRMT1
SCHEMBL14959362 0.93 FUT8 (0.59) FUT8CHATUSP2APEX1PRMT1
SCHEMBL12172962 0.93 FUT8 (0.59) FUT8CHATUSP2APEX1PRMT1
SCHEMBL30763643 0.92 FUT8 (0.58) FUT8CHATUSP2APEX1PRMT1
SCHEMBL22768258 0.89 FUT8 (0.64) FUT8CHATUSP2APEX1PRMT1
SCHEMBL14080045 0.89 FUT8 (0.61) FUT8CHATUSP2APEX1PRMT1
SCHEMBL4162603 0.89 FUT8 (0.61) FUT8CHATUSP2APEX1PRMT1
SCHEMBL4162607 0.89 FUT8 (0.61) FUT8CHATUSP2APEX1PRMT1
SCHEMBL20685372 0.87 FUT8 (0.62) FUT8CHATUSP2APEX1PRMT1
SCHEMBL18220826 0.87 FUT8 (0.62) FUT8CHATUSP2APEX1PRMT1

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
EP-3434735-A1 REACTIVE BLACK DYE COMPOSITION AND METHOD FOR DYING FIBERS USING THE SAME Everlight Chemical Industrial Corporation (TW) 2019-01-30 — — EP disclosed
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