SCHEMBL14045198

SCHEMBL14045198

CSc1nc(Cl)nc(Nc2cc(S(=O)(=O)O)cc3cc(S(=O)(=O)O)c(N=Nc4cc(Nc5nc(Cl)nc(OC(O)CS)n5)ccc4S(=O)(=O)O)c(O)c23)n1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.58
▸ ENPP2 Q13822 8/20 0.37
▸ PRMT1 Q99873 2/20 0.36
▸ CARM1 Q86X55 1/20 0.36
▸ MEN1 O00255 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ CYP1A2 P05177 2/20 0.34
▸ CYP2C9 P11712 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ DNASE1L3 Q13609 1/20 0.33
▸ CD40 P25942 1/20 0.31
▸ CD40LG P29965 1/20 0.31
▸ CHAT P28329 2/20 0.31
▸ PHLPP2 Q6ZVD8 1/20 0.31
▸ USP2 O75604 1/20 0.31
▸ APEX1 P27695 1/20 0.31
▸ ENPP3 O14638 1/20 0.30
▸ ENPP1 P22413 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
SCHEMBL14045252 0.82 FUT8 (0.43) FUT8ENPP2PRMT1CARM1CYP1A2
SCHEMBL14045203 0.81 PRMT1 (0.42) FUT8ENPP2PRMT1CARM1CD40
SCHEMBL14020373 0.78 FUT8 (0.52) FUT8ENPP2PRMT1CARM1CHAT
SCHEMBL14045146 0.77 FUT8 (0.43) FUT8ENPP2PRMT1CARM1MEN1
SCHEMBL7777246 0.76 FUT8 (0.71) FUT8ENPP2PRMT1CARM1MEN1
SCHEMBL13474896 0.74 FUT8 (1.00) FUT8ENPP2PRMT1CARM1MEN1
SCHEMBL31474592 0.74 FUT8 (1.00) FUT8ENPP2PRMT1CARM1MEN1
SCHEMBL8521120 0.74 FUT8 (0.88) FUT8ENPP2PRMT1CARM1MEN1
SCHEMBL9454071 0.74 FUT8 (0.88) FUT8ENPP2PRMT1CARM1MEN1
SCHEMBL14135301 0.73 FUT8 (0.92) FUT8ENPP2PRMT1CARM1MEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7439340-B2 For exhaust dyeing, cold batch-up dyeing and continuous dyeing EVERLIGHT USA, INC. (US) 2008-10-21 — — US disclosed
US-20080207881-A1 Reactive dyes containing an alkylthio-s-triazinyl reactive group EVERLIGHT USA, INC. (US) 2008-08-28 — — US disclosed
US-20080039614-A1 Reactive dyes containing an alkylthio-s-triazinyl reactive group EVERLIGHT USA, INC. (US) 2008-02-14 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080207881-A1 Reactive dyes containing an alkylthio-s-triazinyl reactive group TST, IK, NOX5 FUT8 672/4885ENPP2 2713/4885PRMT1 496/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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