SCHEMBL4448605

SCHEMBL4448605

O=C(O)Cc1cccc(COc2ccc(-c3cccc(CO)c3)cc2)c1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 12/20 0.61
▸ AKR1B1 P15121 1/20 0.61
▸ FFAR4 Q5NUL3 1/20 0.61
▸ NR4A2 P43354 1/20 0.53
▸ PPARD Q03181 3/20 0.52
▸ PPARG P37231 1/20 0.52
▸ PTPRC P08575 1/20 0.51
▸ PTPN1 P18031 1/20 0.51
▸ PTGER4 P35408 1/20 0.51
▸ PTGER3 P43115 1/20 0.51
▸ NR1H2 P55055 2/20 0.51
▸ NR1H3 Q13133 2/20 0.51
▸ RXRA P19793 1/20 0.51
▸ MRGPRX4 Q96LA9 1/20 0.50
▸ NR1H4 Q96RI1 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
SCHEMBL18165305 0.87 FFAR1 (0.77) FFAR1AKR1B1FFAR4PTGER4PTGER3
SCHEMBL12585458 0.86 GSTP1 (0.58) FFAR1AKR1B1FFAR4NR4A2PPARD
SCHEMBL13460872 0.86 FFAR1 (0.68) FFAR1AKR1B1FFAR4NR4A2PPARD
SCHEMBL4442371 0.84 MRGPRX4 (0.71) NR4A2MRGPRX4NR1H4
SCHEMBL13460871 0.84 FFAR1 (0.60) FFAR1AKR1B1FFAR4NR4A2MRGPRX4
SCHEMBL13460992 0.83 FFAR1 (0.74) FFAR1AKR1B1FFAR4PPARDPPARG
SCHEMBL7030142 0.83 ACMSD (0.58) AKR1B1RXRANR1H4
SCHEMBL13460803 0.83 NR4A2 (0.66) FFAR1FFAR4NR4A2PPARDNR1H2
SCHEMBL17954222 0.82 FFAR1 (0.52) FFAR1AKR1B1FFAR4NR4A2PPARD
SCHEMBL1744794 0.82 FFAR1 (0.85) FFAR1AKR1B1FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090156635-A1 BIARYLOXYMETHYLARENECARBOXYLIC ACIDS AS GLYCOGEN SYNTHASE ACTIVATORS GILLESPIE PAUL 2009-06-18 — — US claimed
US-20060122256-A1 Biaryloxymethylarenecarboxylic acids as glycogen synthase activators GILLESPIE PAUL 2006-06-08 — — US claimed
US-20090156635-A1 BIARYLOXYMETHYLARENECARBOXYLIC ACIDS AS GLYCOGEN SYNTHASE ACTIVATORS GILLESPIE PAUL 2009-06-18 — — US disclosed
US-20090156635-A1 BIARYLOXYMETHYLARENECARBOXYLIC ACIDS AS GLYCOGEN SYNTHASE ACTIVATORS GILLESPIE PAUL 2009-06-18 — — US disclosed
US-20090156635-A1 BIARYLOXYMETHYLARENECARBOXYLIC ACIDS AS GLYCOGEN SYNTHASE ACTIVATORS GILLESPIE PAUL 2009-06-18 — — US disclosed
US-7524870-B2 Biaryloxymethylarenecarboxylic acids as glycogen synthase activators HOFFMANN-LA ROCHE INC. (US) 2009-04-28 — — US disclosed
US-7524870-B2 Biaryloxymethylarenecarboxylic acids as glycogen synthase activators HOFFMANN-LA ROCHE INC. (US) 2009-04-28 — — US disclosed
US-7524870-B2 Biaryloxymethylarenecarboxylic acids as glycogen synthase activators HOFFMANN-LA ROCHE INC. (US) 2009-04-28 — — US disclosed
EP-1819691-A2 BIARYLOXYMETHYLARENE CARBOXYLIC ACIDS F. Hoffmann-Roche AG (CH) 2007-08-22 — — EP disclosed
WO-2006058648-A2 BIARYLOXYMETHYLARENE CARBOXYLIC ACIDS F. HOFFMANN-LA ROCHE AG (CH) 2006-06-08 — — WO disclosed
US-20060122256-A1 Biaryloxymethylarenecarboxylic acids as glycogen synthase activators GILLESPIE PAUL 2006-06-08 — — 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-20090156635-A1 BIARYLOXYMETHYLARENECARBOXYLIC ACIDS AS GLYCOGEN SYNTHASE ACTIVATORS GYS2, GYS1, GSK3A FFAR1 472/4885AKR1B1 76/4885FFAR4 744/4885
US-20060122256-A1 Biaryloxymethylarenecarboxylic acids as glycogen synthase activators GYS2, GYS1, GSK3A FFAR1 472/4885AKR1B1 76/4885FFAR4 744/4885

“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.

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