SCHEMBL6802985

SCHEMBL6802985

CCO/C(=C/c1ccc(OCC2CN(C)c3ccccc3O2)cc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 15/20 0.52
PTGDR Q13258 2/20 0.50
TBXA2R P21731 1/20 0.50

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
SCHEMBL6802981 1.00 PTGIR (0.52) PTGIRPTGDRTBXA2R
SCHEMBL6802991 1.00 PTGIR (0.52) PTGIRPTGDRTBXA2R
SCHEMBL14265713 0.92 PTGIR (0.50) PTGIRPTGDRTBXA2R
SCHEMBL6316993 0.91 PTGIR (0.49) PTGIRPTGDRTBXA2R
SCHEMBL6316987 0.91 PTGIR (0.49) PTGIRPTGDRTBXA2R
SCHEMBL14286249 0.87 PTGIR (0.50) PTGIRPTGDRTBXA2R
SCHEMBL6797753 0.87 SIRT1 (0.44) PTGIR
SCHEMBL6797758 0.87 SIRT1 (0.44) PTGIR
SCHEMBL6797764 0.87 SIRT1 (0.44) PTGIR
SCHEMBL27576353 0.82 PTGIR (0.44) PTGIRPTGDRTBXA2R

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-6809095-B2 NOVEL ANTITOBESITY AND HYPOCHOLESTEROLEMIC COMPOUNDS LOWER TOTAL CHOLESTEROL; INCREASE HIGH DENSITY LIPOPROTEIN (HDL) AND DECREASE LOW DENSTIY LIPOPROTEIN DR. REDDY'S LABORATORIES LTD. (IN) 2004-10-26 US claimed
US-20010051619-A1 Novel bicyclic compounds and their use in medicine; process for their preparation and pharmaceutical compositions containing them DR. REDDY'S RESEARCH FOUNDATION AND REDDY-CHEMINOR, INC. 2001-12-13 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-20010051619-A1 Novel bicyclic compounds and their use in medicine; process for their preparation and pharmaceutical compositions containing them CPT1A, GPR119, SLC5A1 PTGIR 665/4885PTGDR 1747/4885TBXA2R 417/4885

“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.