SCHEMBL4032129

SCHEMBL4032129

C=C(CSCC=C(C)CCC=C(C)CCC=C(C)C)C(=O)O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.72
KMT2A Q03164 3/20 0.72
TRPA1 O75762 2/20 0.72
MEN1 O00255 2/20 0.72
ALDH1A1 P00352 2/20 0.56
ICMT O60725 4/20 0.54
FNTA P49354 6/20 0.47
FNTB P49356 6/20 0.47
CYP3A4 P08684 2/20 0.45
GMNN O75496 1/20 0.45
LMNA P02545 1/20 0.45
CYP1A2 P05177 1/20 0.45
POLB P06746 1/20 0.45
CYP2C9 P11712 1/20 0.45
TSHR P16473 1/20 0.45
NFKB1 P19838 1/20 0.45
CDK2 P24941 1/20 0.45
RECQL P46063 1/20 0.45
BLM P54132 1/20 0.45
HIF1A Q16665 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
SCHEMBL3409241 0.86 MAPT (0.79) MAPTKMT2ATRPA1MEN1ALDH1A1
SCHEMBL12793914 0.86 MAPT (0.79) MAPTKMT2ATRPA1MEN1ALDH1A1
SCHEMBL4023754 0.84 MAPT (0.62) MAPTKMT2ATRPA1MEN1ALDH1A1
Farnesylthioacetic Acid SCHEMBL7775705 0.84 MAPT (1.00) MAPTKMT2ATRPA1MEN1ALDH1A1
Farnesylthioacetic Acid SCHEMBL1962463 0.84 MAPT (1.00) MAPTKMT2ATRPA1MEN1ALDH1A1
SCHEMBL14672118 0.82 MAPT (0.78) MAPTKMT2ATRPA1MEN1ALDH1A1
SCHEMBL14660861 0.82 MAPT (0.97) MAPTKMT2ATRPA1MEN1ALDH1A1
SCHEMBL1155126 0.82 KMT2A (0.59) MAPTKMT2ATRPA1MEN1ALDH1A1
SCHEMBL1155187 0.82 KMT2A (0.59) MAPTKMT2ATRPA1MEN1ALDH1A1
SCHEMBL7586426 0.82 KMT2A (0.59) MAPTKMT2ATRPA1MEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090155186-A1 Compositions and methods for treating inflammatory conditions SIGNUM BIOSCENCES, INC. (NJ) 2009-06-18 US claimed
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 MAPT 3196/4885KMT2A 3832/4885TRPA1 440/4885

“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.