SCHEMBL4896489

SCHEMBL4896489

O=C(O)CCc1ccc(OCCOc2ccc(Oc3ccccc3)cc2)cc1CNC(=O)c1ccccn1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.50
PPARA Q07869 11/20 0.50
TSHR P16473 1/20 0.48
MAPK14 Q16539 1/20 0.46
PPARD Q03181 2/20 0.44
MAPK8 P45983 1/20 0.42
LTA4H P09960 1/20 0.42

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
SCHEMBL4888213 0.97 PPARG (0.49) PPARGPPARATSHRMAPK14PPARD
SCHEMBL4891450 0.97 PPARG (0.49) PPARGPPARATSHRMAPK14PPARD
SCHEMBL4896276 0.92 PPARG (0.51) PPARGPPARATSHRPPARD
SCHEMBL4888233 0.90 PPARG (0.49) PPARGPPARATSHRPPARD
SCHEMBL4885788 0.89 PPARG (0.51) PPARGPPARATSHR
SCHEMBL4895315 0.87 PPARG (0.48) PPARGPPARATSHR
SCHEMBL4895959 0.87 PPARG (0.50) PPARGPPARATSHRMAPK8
SCHEMBL4897935 0.87 PPARG (0.48) PPARGPPARATSHR
SCHEMBL4893180 0.86 PPARG (0.51) PPARGPPARAMAPK14PPARDLTA4H
SCHEMBL4889380 0.85 PPARG (0.49) PPARGPPARATSHRMAPK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007122277-A1 4-ACYLOYLOXY-2H-1,4-BENZOXAZIN-3-(4H)ONE DERIVATIVES WITH PHYTOTOXIC ACTIVITY UNIVERSIDAD DE CÁDIZ (ES) 2007-11-01 WO claimed
US-20080167310-A1 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS (PPAR) GOSSETT LYNN STACY 2008-07-10 US disclosed
US-20080167310-A1 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS (PPAR) GOSSETT LYNN STACY 2008-07-10 US disclosed
US-20080167310-A1 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS (PPAR) GOSSETT LYNN STACY 2008-07-10 US disclosed
US-7282501-B2 Modulators of peroxisome proliferator activated receptors (PPAR) ELI LILLY AND COMPANY (US) 2007-10-16 US disclosed
US-7282501-B2 Modulators of peroxisome proliferator activated receptors (PPAR) ELI LILLY AND COMPANY (US) 2007-10-16 US disclosed
US-7282501-B2 Modulators of peroxisome proliferator activated receptors (PPAR) ELI LILLY AND COMPANY (US) 2007-10-16 US disclosed
EP-1401434-B1 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS (PPAR) LILLY CO ELI (US) 2006-11-15 EP disclosed
US-20050075378-A1 Modulators of peroxisome proliferator activated receptors (ppar) ELI LILLY AND COMPANY 2005-04-07 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 (2 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-20050075378-A1 Modulators of peroxisome proliferator activated receptors (ppar) PPARG, PPARA, PPARD PPARG 1/4885PPARA 2/4885TSHR 1255/4885
US-20080167310-A1 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS (PPAR) PPARG, PPARA, PPARD PPARG 1/4885PPARA 2/4885TSHR 1255/4885

“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.