SCHEMBL2897652

SCHEMBL2897652

CC(=O)Nc1cc(S(=O)(=O)[O-])cc2cc(S(=O)(=O)[O-])c(N=Nc3ccc(S(=O)(=O)CCOS(=O)(=O)[O-])cc3O)c(O)c12.CC(=O)Nc1cc(S(=O)(=O)[O-])cc2cc(S(=O)(=O)[O-])c(N=Nc3ccc(S(=O)(=O)CCOS(=O)(=O)[O-])cc3O)c(O)c12.[Cu+2].[Cu+2].[Cu+2]

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.55
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ POLB P06746 1/20 0.45
▸ GRK2 P25098 1/20 0.45
▸ PLEC Q15149 1/20 0.45
▸ USP2 O75604 1/20 0.44
▸ PTPN1 P18031 1/20 0.44
▸ ATM Q13315 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ ENPP2 Q13822 6/20 0.40
▸ CA2 P00918 1/20 0.39
▸ CA3 P07451 1/20 0.39
▸ PRMT1 Q99873 1/20 0.37
▸ APEX1 P27695 2/20 0.36
▸ CYP1A2 P05177 2/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ DNASE1L3 Q13609 1/20 0.35
▸ HTT P42858 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
SCHEMBL29383259 0.92 THRB (0.57) THRBMEN1KMT2APOLBGRK2
SCHEMBL4991205 0.85 PRMT1 (0.48) THRBMEN1KMT2AENPP2CA2
SCHEMBL4991193 0.85 PRMT1 (0.48) THRBMEN1KMT2AENPP2CA2
SCHEMBL29637793 0.83 THRB (0.48) THRBMEN1KMT2APOLBGRK2
SCHEMBL2898227 0.81 THRB (0.54) THRBMEN1KMT2APOLBGRK2
SCHEMBL29404912 0.79 ENPP2 (0.51) THRBMEN1KMT2APOLBGRK2
SCHEMBL13880703 0.79 PRMT1 (0.48) THRBMEN1KMT2APOLBGRK2
SCHEMBL28482747 0.78 CA2 (0.45) THRBMEN1KMT2AENPP2CA2
SCHEMBL28343203 0.77 USP2 (0.52) THRBMEN1KMT2APOLBGRK2
SCHEMBL4807909 0.76 PTPN1 (0.57) THRBMEN1KMT2APOLBGRK2

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
EP-2189503-A1 NOVEL NUCLEIC ACID DERIVATIVE INTO WHICH GIVEN COMPOUND HAS BEEN INTRODUCED AND METHOD FOR PRODUCING THE SAME Biodynamics Laboratory, INC. (JP) 2010-05-26 — — EP disclosed
US-20090090628-A1 NUCLEIC ACID DERIVATIVES AND METHODS OF USE BIODYNAMICS LABORATORY, INC (JP) 2009-04-09 — — 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-20090090628-A1 NUCLEIC ACID DERIVATIVES AND METHODS OF USE NSUN3, TRDMT1, NSUN2 THRB 2493/4885MEN1 2655/4885KMT2A 2066/4885

“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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