SCHEMBL4176535

SCHEMBL4176535

Cc1cc(C)c(S(=O)(=O)N(CCCCN)C2(c3ccccc3)CC2)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 2/20 0.38
NFE2L2 Q16236 1/20 0.38
OPRM1 P35372 8/20 0.36
OPRL1 P41146 8/20 0.36
OPRK1 P41145 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
F2 P00734 3/20 0.33
ALDH1A1 P00352 1/20 0.33
RECQL P46063 1/20 0.33
CCR5 P51681 1/20 0.32
NR3C1 P04150 2/20 0.32
PGR P06401 1/20 0.32
NR3C2 P08235 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
SCHEMBL4167988 0.84 L3MBTL1 (0.49) KEAP1NFE2L2OPRM1OPRL1L3MBTL1
SCHEMBL4181762 0.82 MAOB (0.42) L3MBTL1ALDH1A1RECQL
SCHEMBL7518601 0.72 NPSR1 (0.38) KEAP1NFE2L2F2
SCHEMBL7517054 0.72 F2 (0.41) KEAP1NFE2L2F2ALDH1A1
SCHEMBL7522685 0.71 F2 (0.40) KEAP1NFE2L2F2
SCHEMBL7516866 0.71 F2 (0.40) KEAP1NFE2L2F2
SCHEMBL4743601 0.69 F2 (0.38) KEAP1NFE2L2F2ALDH1A1NR3C1
SCHEMBL14080753 0.68 F2 (0.37) KEAP1NFE2L2F2ALDH1A1NR3C1
SCHEMBL4746857 0.68 SMN1; SMN2 (0.39) KEAP1NFE2L2F2
SCHEMBL14080669 0.68 F2 (0.37) KEAP1NFE2L2F2ALDH1A1NR3C1

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-20090143456-A1 Polyamine Analogs as Modulators of Cell Migration and Cell Motility PROGEN PHARMACEUTICALS, INC. 2009-06-04 US disclosed
WO-2006086773-A2 POLYAMINE ANALOGS AS MODULATORS OF CELL MIGRATION AND CELL MOTILITY CELLGATE, INC. (US) 2006-08-17 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-20090143456-A1 Polyamine Analogs as Modulators of Cell Migration and Cell Motility SRM, MIF, PTGIS KEAP1 3851/4885NFE2L2 4434/4885OPRM1 3748/4885

“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.