SCHEMBL16330373

SCHEMBL16330373

Nc1nc(Cl)nc(Nc2ccc(S(=O)(=O)O)c(/N=N/c3c(S(=O)(=O)O)cc4cc(S(=O)(=O)OI)c(/N=N/c5cc(S(=O)(=O)O)ccc5S(=O)(=O)O)c(N)c4c3O)c2)n1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.53
▸ PRMT1 Q99873 2/20 0.41
▸ CYP1A2 P05177 2/20 0.41
▸ MEN1 O00255 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ ENPP2 Q13822 7/20 0.39
▸ CARM1 Q86X55 1/20 0.38
▸ CYP2C9 P11712 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ DNASE1L3 Q13609 1/20 0.37
▸ CHAT P28329 3/20 0.36
▸ USP2 O75604 1/20 0.36
▸ APEX1 P27695 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ ENPP3 O14638 1/20 0.35
▸ ENPP1 P22413 1/20 0.35
▸ PHLPP2 Q6ZVD8 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
SCHEMBL12172962 0.94 FUT8 (0.59) FUT8PRMT1CYP1A2MEN1HTT
SCHEMBL14959362 0.94 FUT8 (0.59) FUT8PRMT1CYP1A2MEN1HTT
SCHEMBL30763643 0.93 FUT8 (0.58) FUT8PRMT1CYP1A2MEN1HTT
SCHEMBL4162607 0.90 FUT8 (0.61) FUT8PRMT1CYP1A2MEN1HTT
SCHEMBL14080045 0.90 FUT8 (0.61) FUT8PRMT1CYP1A2MEN1HTT
SCHEMBL4162603 0.90 FUT8 (0.61) FUT8PRMT1CYP1A2MEN1HTT
SCHEMBL20685317 0.89 FUT8 (0.60) FUT8PRMT1CYP1A2MEN1HTT
SCHEMBL22768258 0.88 FUT8 (0.64) FUT8PRMT1CYP1A2MEN1HTT
SCHEMBL20685319 0.87 FUT8 (0.57) FUT8PRMT1CYP1A2MEN1HTT
SCHEMBL14045325 0.86 FUT8 (0.60) FUT8PRMT1CYP1A2MEN1HTT

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-9403987-B2 Charged particles BASF SE (DE) 2016-08-02 — — US disclosed
US-20120229884-A1 CHARGED PARTICLES BASF SE (DE) 2012-09-13 — — 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-20120229884-A1 CHARGED PARTICLES POLE3, POLD3, IPO4 FUT8 769/4885PRMT1 4254/4885CYP1A2 4304/4885

“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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