SCHEMBL7125891

SCHEMBL7125891

CC(C)(C)NS(=O)(=O)c1ccccc1-c1ccc(C(=O)O)c(CBr)c1

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 19/20 0.47
FEN1 P39748 18/20 0.47
ACLY P53396 1/20 0.45

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
SCHEMBL7130070 0.83 ALOX5AP (0.55) ALOX5APFEN1
SCHEMBL7237315 0.80 ALOX5AP (0.53) ALOX5APFEN1
SCHEMBL9118640 0.80 ALOX5AP (0.58) ALOX5APFEN1
SCHEMBL2280981 0.76 ALOX5AP (0.54) ALOX5APFEN1
SCHEMBL890690 0.76 ALOX5AP (0.54) ALOX5APFEN1
SCHEMBL15916565 0.75 ALOX5AP (0.60) ALOX5APFEN1
SCHEMBL15936747 0.74 ALOX5AP (0.62) ALOX5APFEN1
SCHEMBL7128878 0.74 ALOX5AP (0.53) ALOX5APFEN1
SCHEMBL1968159 0.73 ALOX5AP (0.59) ALOX5APFEN1
SCHEMBL7995533 0.73 ALOX5AP (0.49) ALOX5APFEN1

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-20030114448-A1 Inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. 2003-06-19 US disclosed
WO-2002096873-A1 ISOINDOLE AND ISOQUINOLINE DERIVATIVES AS INHIBITORS OF FACTOR XA MILLENNIUM PHARMACEUTICALS, INC. (US) 2002-12-05 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-20030114448-A1 Inhibitors of factor Xa SERPINC1, F11, TFPI ALOX5AP 415/4885FEN1 1574/4885ACLY 1491/4885

“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.