SCHEMBL4028704

SCHEMBL4028704

CC(C)=CCCC(C)=CCCC(C)=CCSC[C@H](NC(=O)c1ccccc1)C(=O)O

nearest known ligand 0.83

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ICMT O60725 15/20 0.83
MAPT P10636 2/20 0.71
ALDH1A1 P00352 1/20 0.71
MEN1 O00255 1/20 0.51
TRPA1 O75762 1/20 0.51
KMT2A Q03164 1/20 0.51

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
SCHEMBL20390363 0.92 ICMT (0.78) ICMTMAPTALDH1A1MEN1TRPA1
SCHEMBL12466774 0.90 ICMT (0.72) ICMTMAPTALDH1A1
SCHEMBL5427483 0.87 ICMT (0.66) ICMTMAPTALDH1A1
SCHEMBL14596313 0.87 ICMT (0.70) ICMTMAPTALDH1A1
SCHEMBL3423544 0.86 ICMT (0.75) ICMTMAPTALDH1A1TRPA1
SCHEMBL3423548 0.86 ICMT (0.75) ICMTMAPTALDH1A1TRPA1
SCHEMBL13253017 0.86 ICMT (0.75) ICMTMAPTALDH1A1TRPA1
SCHEMBL20389919 0.86 ICMT (0.78) ICMTMAPTALDH1A1
SCHEMBL13252994 0.86 ICMT (0.64) ICMTMAPTALDH1A1
SCHEMBL12792939 0.85 MAPT (0.68) ICMTMAPTALDH1A1MEN1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1899480-A4 COMPOSITIONS AND METHODS FOR TREATING INFLAMMATORY CONDITIONS SIGNUM BIOSCIENCES INC (US) 2009-04-22 EP claimed
EP-1899480-A1 COMPOSITIONS AND METHODS FOR TREATING INFLAMMATORY CONDITIONS SIGNUM BIOSCIENCES, INC. (US) 2008-03-19 EP claimed
WO-2006135894-A1 COMPOSITIONS AND METHODS FOR TREATING INFLAMMATORY CONDITIONS SIGNUM BIOSCIENCES, INC. (US) 2006-12-21 WO claimed
US-5202456-A Anticarcinogenic agents; methylating transferase inhibitors; farnesyl or geranyl sulfur-, oxygen or selenium-containing derivatives THE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1993-04-13 US claimed
US-20090155186-A1 Compositions and methods for treating inflammatory conditions SIGNUM BIOSCENCES, INC. (NJ) 2009-06-18 US disclosed
EP-1899480-A4 COMPOSITIONS AND METHODS FOR TREATING INFLAMMATORY CONDITIONS SIGNUM BIOSCIENCES INC (US) 2009-04-22 EP disclosed
EP-1899480-A1 COMPOSITIONS AND METHODS FOR TREATING INFLAMMATORY CONDITIONS SIGNUM BIOSCIENCES, INC. (US) 2008-03-19 EP disclosed
WO-2006135894-A1 COMPOSITIONS AND METHODS FOR TREATING INFLAMMATORY CONDITIONS SIGNUM BIOSCIENCES, INC. (US) 2006-12-21 WO disclosed
US-5202456-A Anticarcinogenic agents; methylating transferase inhibitors; farnesyl or geranyl sulfur-, oxygen or selenium-containing derivatives THE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1993-04-13 US disclosed
WO-1992018465-A2 COMPOUNDS FOR INHIBITION OF PROTEIN METHYLATION THE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1992-10-29 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-20090155186-A1 Compositions and methods for treating inflammatory conditions TNF, TRAF6, RELA ICMT 3602/4885MAPT 3196/4885ALDH1A1 2832/4885

“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.