SCHEMBL6653115

SCHEMBL6653115

CCOc1ccc(CC(OC(C)C)C(=O)OC)cc1

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACACB O00763 17/20 0.52
GAA P10253 1/20 0.50
RAB9A P51151 1/20 0.50
PPARA Q07869 1/20 0.48

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
SCHEMBL6653118 1.00 ACACB (0.52) ACACBGAARAB9APPARA
SCHEMBL14285179 0.87 ACACB (0.53) ACACBGAARAB9APPARA
SCHEMBL14285167 0.87 ACACB (0.53) ACACBGAARAB9APPARA
SCHEMBL4347157 0.85 PPARA (0.61) PPARA
SCHEMBL3993110 0.82 ESR1 (0.58) GAARAB9A
SCHEMBL13792677 0.82 ESR1 (0.58) GAARAB9A
SCHEMBL13780265 0.82 ACACB (0.57) ACACBGAARAB9A
SCHEMBL27592750 0.81 ESR1 (0.42) RAB9A
SCHEMBL20395698 0.80 PPARG (0.62) ACACBGAARAB9APPARA
SCHEMBL6654616 0.79 KDM4E (0.39)

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-20040102634-A1 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-05-27 US disclosed
EP-1380562-A1 CARBOXYLIC ACID DERIVATIVE AND SALT THEREOF Eisai Co., Ltd. (JP) 2004-01-14 EP 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-20040102634-A1 Carboxylic acid derivative and salt thereof GPR119, IRS1, SLC5A1 ACACB 1212/4885GAA 2303/4885RAB9A 2956/4885

“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.