SCHEMBL6483729

SCHEMBL6483729

O=C(O)CCc1ccc(OCC=C(c2ccc(-c3ccsc3)cc2)c2ccc(-c3ccsc3)cc2)c(I)c1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.48
PPARD Q03181 8/20 0.46
HDAC1 Q13547 3/20 0.40
PPARG P37231 4/20 0.37
PPARA Q07869 4/20 0.37
LTB4R Q15722 3/20 0.36
LTA4H P09960 1/20 0.36
HDAC2 Q92769 1/20 0.35
SLC6A9 P48067 1/20 0.35
FFAR4 Q5NUL3 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34

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
SCHEMBL6474172 0.90 PPARD (0.52) FFAR1PPARDHDAC1PPARGPPARA
SCHEMBL6479327 0.88 PPARD (0.51) PPARDHDAC1PPARGPPARALTB4R
SCHEMBL6482970 0.88 PPARD (0.55) FFAR1PPARDHDAC1PPARGPPARA
SCHEMBL6529335 0.88 FFAR1 (0.60) FFAR1PPARDPPARGPPARALTB4R
SCHEMBL6483699 0.84 FFAR1 (0.57) FFAR1PPARDPPARGPPARAFFAR4
SCHEMBL6473972 0.83 FFAR1 (0.50) FFAR1PPARDHDAC1PPARGHDAC2
SCHEMBL6480528 0.83 PPARD (0.66) FFAR1PPARDPPARGPPARALTA4H
SCHEMBL6480739 0.82 FFAR1 (0.48) FFAR1PPARDHDAC1PPARGPPARA
SCHEMBL6474071 0.82 FFAR1 (0.55) FFAR1PPARDPPARGPPARAFFAR4
SCHEMBL6482415 0.82 FFAR1 (0.55) FFAR1PPARDFFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6869967-B2 Peroxisome proliferator-activated receptor (PPAR) active vinyl carboxylic acid derivatives NOVO NORDISK A/S (DK) 2005-03-22 US claimed
EP-1414778-A1 NOVEL VINYL CARBOXYLIC ACID DERIVATIVES AND THEIR USE AS ANTIDIABETICS ETC. NOVO NORDISK A/S (DK) 2004-05-06 EP claimed
US-20030139473-A1 Novel compounds, their preparation and use VTVX HOLDINGS II LLC 2003-07-24 US claimed
WO-2003011807-A1 NOVEL VINYL CARBOXYLIC ACID DERIVATIVES AND THEIR USE AS ANTIDIABETICS ETC. NOVO NORDISK A/S (DK) 2003-02-13 WO claimed
US-6869967-B2 Peroxisome proliferator-activated receptor (PPAR) active vinyl carboxylic acid derivatives NOVO NORDISK A/S (DK) 2005-03-22 US disclosed
US-20030139473-A1 Novel compounds, their preparation and use VTVX HOLDINGS II LLC 2003-07-24 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-20030139473-A1 Novel compounds, their preparation and use PPARG, PPARD, PPARA FFAR1 22/4885PPARD 2/4885HDAC1 1410/4885

“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.