SCHEMBL2537453

SCHEMBL2537453

O=C(O)CCc1cc(-c2ccc(OC(F)(F)F)cc2)ccc1Oc1ccc(OC(F)(F)F)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 10/20 0.48
▸ FFAR4 Q5NUL3 9/20 0.48
▸ SLC6A4 P31645 4/20 0.48
▸ SLC6A2 P23975 3/20 0.48
▸ PPARD Q03181 2/20 0.47
▸ PPARG P37231 1/20 0.47
▸ PPARA Q07869 1/20 0.47
▸ AURKA O14965 1/20 0.44
▸ TPX2 Q9ULW0 1/20 0.44
▸ CYP2C9 P11712 2/20 0.43
▸ SLC6A3 Q01959 1/20 0.43
▸ SCN5A Q14524 1/20 0.43
▸ CACNA1C Q13936 1/20 0.43
▸ PTGER4 P35408 1/20 0.42
▸ MME P08473 1/20 0.42

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
SCHEMBL2541537 0.94 SLC6A2 (0.49) FFAR1FFAR4SLC6A4SLC6A2PPARD
SCHEMBL2536068 0.92 FFAR1 (0.46) FFAR1FFAR4SLC6A4SLC6A2PPARD
SCHEMBL15434106 0.90 FFAR1 (0.48) FFAR1FFAR4SLC6A4SLC6A2PPARD
SCHEMBL2538764 0.85 FFAR1 (0.55) FFAR1FFAR4PPARDPTGER4MME
SCHEMBL3859024 0.85 FFAR4 (0.51) FFAR1FFAR4AURKATPX2CYP2C9
SCHEMBL15434102 0.84 FFAR1 (0.50) FFAR1FFAR4PPARDPPARGPPARA
SCHEMBL15434118 0.84 PPARD (0.46) FFAR1FFAR4SLC6A4SLC6A2PPARD
SCHEMBL2534776 0.83 FFAR1 (0.56) FFAR1FFAR4PPARDPTGER4
SCHEMBL12952588 0.83 FFAR4 (0.49) FFAR1FFAR4PPARDPPARGPPARA
SCHEMBL15434111 0.83 NPSR1 (0.47) FFAR1FFAR4SLC6A4SLC6A2PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8044236-B2 Inhibitors against plasminogen activator inhibitor-1 (PAI-1); anticoagulants; 2-(aryl or aralkyloxy-)-5-(aryl)phenyl}acetic acid (or derivatives of propionic acid, propenoic acid, N-oxamic acid or 1H-tetrazol-5-yl); occlusion, stenosis; low molecular weight; gene expression inhibition INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2011-10-25 — — US disclosed
EP-2080751-A1 CARBOXYLIC ACID DERIVATIVE Institute of Medicinal Molecular Design, Inc. (JP) 2009-07-22 — — EP disclosed
US-20080275116-A1 Carboxilic acid derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2008-11-06 — — 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-20080275116-A1 Carboxilic acid derivatives SERPINE1, CTRL, SERPINC1 FFAR1 710/4885FFAR4 2537/4885SLC6A4 4560/4885

“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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