SCHEMBL1269941

SCHEMBL1269941

CCS(=O)(=O)c1ccc2sc3c(O)c(C([NH])=O)nc(Cl)c3c2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 3/20 0.45
KDM4E B2RXH2 2/20 0.34
MAPT P10636 1/20 0.34
PLK4 O00444 1/20 0.32
AURKA O14965 1/20 0.32
ROCK2 O75116 1/20 0.32
CHEK2 O96017 1/20 0.32
PIM1 P11309 1/20 0.32
CDK2 P24941 1/20 0.32
FLT4 P35916 1/20 0.32
KDR P35968 1/20 0.32
MAPK8 P45983 1/20 0.32
MAPK9 P45984 1/20 0.32
CSNK1D P48730 1/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
LIMK1 P53667 1/20 0.32
CSNK2A1 P68400 1/20 0.32
CDK5 Q00535 1/20 0.32
ROCK1 Q13464 1/20 0.32

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
SCHEMBL1268889 0.85 EGLN1 (0.67) EGLN1
SCHEMBL1269835 0.84 EGLN1 (0.49) EGLN1MAPTALDH1A1POLBLMNA
SCHEMBL1270094 0.83 EGLN1 (0.45) EGLN1KDM4EMAPTALDH1A1MEN1
SCHEMBL1269068 0.81 EGLN1 (0.45) EGLN1PIM1
SCHEMBL1270017 0.77 EGLN1 (0.45) EGLN1MAPTPIM1CSNK1DDYRK1A
SCHEMBL1270323 0.76 EGLN1 (0.49) EGLN1
SCHEMBL1270577 0.74 EGLN1 (0.53) EGLN1PIM1PPARA
SCHEMBL1269035 0.74 EGLN1 (0.68) EGLN1MAPTTP53
SCHEMBL1270343 0.72 EGLN1 (0.71) EGLN1
SCHEMBL1270563 0.69 EGLN1 (0.67) EGLN1MAPT

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 5/4885KDM4E 364/4885MAPT 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.