SCHEMBL1269657

SCHEMBL1269657

O=C(O)CNC(=O)c1nc(Cl)c2c(sc3ccc(NS(=O)(=O)c4ccccc4)cc32)c1O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 13/20 0.69
FTO Q9C0B1 3/20 0.48
BBOX1 O75936 2/20 0.48
THRA P10827 3/20 0.43
THRB P10828 3/20 0.43
HDAC1 Q13547 1/20 0.42
HIF1AN Q9NWT6 1/20 0.39
PRSS12 P56730 1/20 0.39
ALDH1A1 P00352 2/20 0.38
GAA P10253 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
ALOX12 P18054 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
DYRK1A Q13627 1/20 0.38
ACLY P53396 1/20 0.38
GFER P55789 2/20 0.37

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
SCHEMBL1270343 0.87 EGLN1 (0.71) EGLN1FTOBBOX1THRATHRB
SCHEMBL1270027 0.83 EGLN1 (0.71) EGLN1FTOBBOX1THRATHRB
SCHEMBL1269035 0.83 EGLN1 (0.68) EGLN1FTOBBOX1THRATHRB
SCHEMBL1269880 0.82 EGLN1 (0.76) EGLN1FTOBBOX1THRATHRB
SCHEMBL1268889 0.82 EGLN1 (0.67) EGLN1FTOBBOX1THRATHRB
SCHEMBL1269131 0.82 EGLN1 (1.00) EGLN1FTOBBOX1THRATHRB
SCHEMBL1269809 0.82 EGLN1 (0.69) EGLN1FTOBBOX1THRATHRB
SCHEMBL1269955 0.82 EGLN1 (0.69) EGLN1FTOBBOX1THRATHRB
SCHEMBL1270012 0.81 EGLN1 (0.73) EGLN1FTOBBOX1THRATHRB
SCHEMBL1270239 0.81 EGLN1 (0.73) EGLN1FTOBBOX1THRATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110028507-A1 PYRIDINE DERIVATIVES AND METHODS OF USE THEREOF CRYSTALGENOMICS, INC. (KR) 2011-02-03 US claimed
US-20110028507-A1 PYRIDINE DERIVATIVES AND METHODS OF USE THEREOF CRYSTALGENOMICS, INC. (KR) 2011-02-03 US disclosed
EP-2188295-A2 PYRIDINE DERIVATIVES AND METHODS OF USE THEREOF Crystalgenomics, Inc. (KR) 2010-05-26 EP disclosed
WO-2009037570-A2 PYRIDINE DERIVATIVES AND METHODS OF USE THEREOF CRYSTALGENOMICS, INC. (KR) 2009-03-26 WO 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-20110028507-A1 PYRIDINE DERIVATIVES AND METHODS OF USE THEREOF EGLN3, EGLN2, HIF1A EGLN1 5/4885FTO 1284/4885BBOX1 751/4885

“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.