SCHEMBL6813705

SCHEMBL6813705

CCOc1ccc(CCOc2ccc(CC(NC(=O)C(C)C)C(=O)O)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.57
ACE P12821 9/20 0.53
MME P08473 8/20 0.53
CPA1 P15085 8/20 0.53
ACE2 Q9BYF1 8/20 0.53
ITGB3 P05106 5/20 0.52
ITGA2B P08514 5/20 0.52
ITGB1 P05556 2/20 0.49
ITGA4 P13612 2/20 0.49
PPARG P37231 2/20 0.49
PPARA Q07869 1/20 0.49

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
SCHEMBL6813707 1.00 ACACB (0.57) ACACBACEMMECPA1ACE2
SCHEMBL6818126 0.89 GAA (0.57) ACACB
SCHEMBL6818123 0.89 GAA (0.57) ACACB
SCHEMBL6817238 0.88 ACE (0.54) ACEMMECPA1ACE2ITGB3
SCHEMBL6817237 0.88 ACE (0.54) ACEMMECPA1ACE2ITGB3
SCHEMBL6817369 0.83 ACACB (0.57) ACACBPPARGPPARA
SCHEMBL13031464 0.79 FPR2 (0.60) ACEMMECPA1ACE2
SCHEMBL6817962 0.79 IL1RN (0.52) ACACBACEMMECPA1ACE2
SCHEMBL6817956 0.79 IL1RN (0.52) ACACBACEMMECPA1ACE2
SCHEMBL12990186 0.78 MME (0.54) ACACBACEMMECPA1ACE2

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 5 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 disclosed
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
EP-1237857-A1 NEW PHENALKYLOXY-PHENYL DERIVATIVES AstraZeneca AB (SE) 2002-09-11 EP disclosed
WO-2001040170-A1 NEW PHENALKYLOXY-PHENYL DERIVATIVES ASTRAZENECA AB (SE) 2001-06-07 WO 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 ACACB 90/4885ACE 689/4885MME 2115/4885

“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.