SCHEMBL6745494

SCHEMBL6745494

CCCCCCCN(CCc1ccc(CC(OCc2ccccc2)C(=O)OCC)cc1)C(=O)Nc1ccc(OC)cc1OC

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.50
PPARA Q07869 6/20 0.50
PPARD Q03181 4/20 0.50
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
GAA P10253 2/20 0.43
HTT P42858 1/20 0.43
TSHR P16473 1/20 0.43
MAPT P10636 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PLK1 P53350 1/20 0.42
PLK3 Q9H4B4 1/20 0.42
LMNA P02545 1/20 0.42
ALDH1A1 P00352 1/20 0.41
LPAR1 Q92633 1/20 0.40
HPGD P15428 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL6747498 0.93 PPARA (0.52) PPARGPPARAPPARDKMT2AMEN1
SCHEMBL6743040 0.93 PPARA (0.52) PPARGPPARAPPARDKMT2AMEN1
SCHEMBL6745418 0.93 PPARA (0.52) PPARGPPARAPPARDKMT2AMEN1
SCHEMBL6746522 0.88 PPARG (0.49) PPARGPPARAPPARDKMT2AMEN1
SCHEMBL6743512 0.86 PPARA (0.51) PPARGPPARAPPARDKMT2AMEN1
SCHEMBL6743515 0.86 PPARA (0.51) PPARGPPARAPPARDKMT2AMEN1
SCHEMBL6747557 0.86 PPARA (0.51) PPARGPPARAPPARDKMT2AMEN1
SCHEMBL6744712 0.85 PPARG (0.60) PPARGPPARAPPARD
SCHEMBL6358517 0.84 PPARG (0.45) PPARGPPARAPPARDKMT2AMEN1
SCHEMBL6358265 0.83 PPARG (0.47) PPARGPPARAPPARDKMT2AMEN1

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-6699904-B2 PEROXISOME PROLIFERATOR ACTIVATOR RECEPTOR (PPAR) AGONISTS; ATHEROSCLEROSIS AND CARDIOVASCULAR DISORDERS; FOR EXAMPLE, 3-(4-(2-(3-(2,4-DIMETHOXY-PHENYL)-1-HEPTYL-UREIDO)-ETHYL)-PHENYL)-2-ETHOXY -PROPIONIC ACID PFIZER INC. 2004-03-02 US disclosed
US-20020165282-A1 Peroxisome proliferator activator receptor (PPAR) agonists; atherosclerosis and cardiovascular disorders; for example, 3-(4-(2-(3-(2,4-dimethoxy-phenyl)-1-heptyl-ureido)-ethyl)-phenyl)-2-ethoxy -propionic acid HAYWARD CHERYL M (US) 2002-11-07 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 (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-20020165282-A1 Peroxisome proliferator activator receptor (PPAR) agonists; atherosclerosis and cardiovascular disorders; for example, 3-(4-(2-(3-(2,4-dimethoxy-phenyl)-1-heptyl-ureido)-ethyl)-phenyl)-2-ethoxy -propionic acid PPARA, PPARG, PPARD PPARG 2/4885PPARA 1/4885PPARD 3/4885

“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.