SCHEMBL1269835

SCHEMBL1269835

[NH]C(=O)c1nc(Cl)c2c(sc3ccc(S(=O)(=O)c4ccccc4)cc32)c1O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 4/20 0.49
LMNA P02545 3/20 0.32
MAPT P10636 1/20 0.32
NAMPT P43490 4/20 0.32
SLC16A1 P53985 1/20 0.32
HTT P42858 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PDE4B Q07343 1/20 0.31
POLB P06746 1/20 0.31
ACLY P53396 1/20 0.31
ALDH1A1 P00352 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31
MMP12 P39900 1/20 0.31
MMP13 P45452 1/20 0.31

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 0.85 EGLN1 (0.71) EGLN1NAMPT
SCHEMBL1269941 0.84 EGLN1 (0.45) EGLN1LMNAMAPTPOLBALDH1A1
SCHEMBL1270323 0.81 EGLN1 (0.49) EGLN1
SCHEMBL1270577 0.78 EGLN1 (0.53) EGLN1
SCHEMBL1269068 0.76 EGLN1 (0.45) EGLN1L3MBTL1
SCHEMBL1270017 0.76 EGLN1 (0.45) EGLN1MAPT
SCHEMBL1269157 0.75 EGLN1 (0.47) EGLN1MAPTPOLBALDH1A1
SCHEMBL1270094 0.74 EGLN1 (0.45) EGLN1MAPTSLC16A1HTTL3MBTL1
SCHEMBL1269035 0.73 EGLN1 (0.68) EGLN1MAPT
SCHEMBL1268889 0.72 EGLN1 (0.67) EGLN1

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
US-20110028507-A1 PYRIDINE DERIVATIVES AND METHODS OF USE THEREOF CRYSTALGENOMICS, INC. (KR) 2011-02-03 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-20110028507-A1 PYRIDINE DERIVATIVES AND METHODS OF USE THEREOF EGLN3, EGLN2, HIF1A EGLN1 5/4885LMNA 3768/4885MAPT 4478/4885

“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.