SCHEMBL5223483

SCHEMBL5223483

CCCCC(Oc1ccc(C#N)cc1C=O)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.41
PTGES O14684 2/20 0.41
ALOX5 P09917 2/20 0.41
PPARA Q07869 2/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
MGLL Q99685 2/20 0.36
CTRC Q99895 1/20 0.35
ALDH2 P05091 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
FOLH1 Q04609 1/20 0.35
TBXA2R P21731 5/20 0.34
UBLCP1 Q8WVY7 1/20 0.34
MRGPRX4 Q96LA9 1/20 0.34

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
SCHEMBL5671783 0.88 MGLL (0.37) PPARGPTGESALOX5ALDH1A1HPGD
SCHEMBL14707709 0.84 PPARG (0.44) PPARGPTGESALOX5PPARAALDH1A1
SCHEMBL2330339 0.83 PPARA (0.44) PPARGPTGESALOX5PPARAALDH1A1
SCHEMBL2547539 0.83 PTGDR2 (0.51) PPARGPTGESALOX5PPARAALDH1A1
SCHEMBL5223661 0.80 ERAP2 (0.45) PPARGPTGESALOX5ALDH1A1HPGD
SCHEMBL6235795 0.80 PPARG (0.49) PPARGPTGESALOX5PPARAALDH1A1
SCHEMBL6465588 0.79 ERN1 (0.43) PPARGPTGESALOX5ALDH1A1
SCHEMBL2563322 0.79 RORC (0.41) PPARGPTGESALOX5PPARAALDH1A1
SCHEMBL6233340 0.79 ERN1 (0.43) PPARGPTGESALOX5ALDH1A1
SCHEMBL1139006 0.78 PPARG (0.50) PPARGPTGESALOX5PPARAALDH1A1

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-1315710-B1 AMINOALKOXYBENZOYL-BENZOFURAN OR BENZOTHIOPHENE DERIVATIVES, METHOD FOR PREPARING SAME AND COMPOSITIONS CONTAINING SAME SANOFI AVENTIS (FR) 2007-04-25 EP disclosed
US-7148240-B2 Aminoalkoxybenzoyl-benzofuran or benzothiophene derivatives, method for preparing same and compositions containing same SANOFI-AVENTIS (FR) 2006-12-12 US disclosed
US-20040010011-A1 Aminoalkoxybenzoyl-benzofuran or benzothiophene derivatives, method for preparing same and compositions containing same SANOFI (FR) 2004-01-15 US disclosed
EP-1315710-A1 AMINOALKOXYBENZOYL-BENZOFURAN OR BENZOTHIOPHENE DERIVATIVES, METHOD FOR PREPARING SAME AND COMPOSITIONS CONTAINING SAME SANOFI-SYNTHELABO (FR) 2003-06-04 EP disclosed
WO-2002016340-A1 AMINOALKOXYBENZOYL-BENZOFURAN OR BENZOTHIOPHENE DERIVATIVES, METHOD FOR PREPARING SAME AND COMPOSITIONS CONTAINING SAME SANOFI-SYNTHELABO (FR) 2002-02-28 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-20040010011-A1 Aminoalkoxybenzoyl-benzofuran or benzothiophene derivatives, method for preparing same and compositions containing same ABAT, TNNT2, BCAT1 PPARG 1110/4885PTGES 506/4885ALOX5 157/4885

“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.