SCHEMBL6813690

SCHEMBL6813690

CCOC(CO)Cc1ccc(OCCc2ccc(NC(=O)OC(C)(C)C)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 10/20 0.53
PPARG P37231 4/20 0.53
ITGB3 P05106 1/20 0.42
ITGA2B P08514 1/20 0.42
HDAC8 Q9BY41 1/20 0.41
ADAMTS4 O75173 1/20 0.41
CYP17A1 P05093 1/20 0.41
FAAH O00519 1/20 0.40
DRD2 P14416 1/20 0.40
S1PR4 O95977 1/20 0.39
S1PR1 P21453 1/20 0.39
S1PR3 Q99500 1/20 0.39
S1PR5 Q9H228 1/20 0.39

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
SCHEMBL6817531 1.00 PPARA (0.53) PPARAPPARGITGB3ITGA2BHDAC8
SCHEMBL6813874 1.00 PPARA (0.53) PPARAPPARGITGB3ITGA2BHDAC8
SCHEMBL6818140 0.87 PPARA (0.51) PPARAPPARGITGB3ITGA2BHDAC8
SCHEMBL6818144 0.87 PPARA (0.51) PPARAPPARGITGB3ITGA2BHDAC8
SCHEMBL6817490 0.87 PPARA (0.51) PPARAPPARGITGB3ITGA2BHDAC8
SCHEMBL6818110 0.87 PPARA (0.49) PPARAPPARGITGB3ITGA2BHDAC8
SCHEMBL6921681 0.87 PPARA (0.54) PPARAPPARGITGB3ITGA2BHDAC8
SCHEMBL601719 0.86 PPARG (0.72) PPARAPPARGITGB3ITGA2B
SCHEMBL5393093 0.86 PPARG (0.72) PPARAPPARGITGB3ITGA2B
SCHEMBL5388906 0.85 PPARA (0.60) PPARAPPARGITGB3ITGA2BHDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1237857-B1 NEW PHENALKYLOXY-PHENYL DERIVATIVES ASTRAZENECA AB (SE) 2004-06-30 EP claimed
US-6630509-B2 Pharmaceutical medication associated with insulin resistance; patient with prophylaxis conditions having reduced sensitivity to insulin ASTRAZENECA AB (SE) 2003-10-07 US claimed
US-6630509-B2 Pharmaceutical medication associated with insulin resistance; patient with prophylaxis conditions having reduced sensitivity to insulin ASTRAZENECA AB (SE) 2003-10-07 US disclosed
US-20030018207-A1 Phenalkyloxy-phenyl derivatives ASTRAZENECA AB (SE) 2003-01-23 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-20030018207-A1 Phenalkyloxy-phenyl derivatives GPR119, INSR, IAPP PPARA 74/4885PPARG 47/4885ITGB3 1598/4885

“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.