SCHEMBL3973596

SCHEMBL3973596

O=C(Nc1ccc(-c2ccc(OC(Cc3ccccc3)C(=O)O)cc2)cc1)c1ccc(-c2ccc(Cl)cc2)o1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 17/20 0.67
PPARA Q07869 15/20 0.67
PTPN1 P18031 1/20 0.56
TP53 P04637 1/20 0.53
MAPT P10636 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
HTR1A P08908 1/20 0.53
ADORA3 P0DMS8 1/20 0.53
CNR1 P21554 1/20 0.53
DRD1 P21728 1/20 0.53
HTR2A P28223 1/20 0.53
ADORA2A P29274 1/20 0.53
OPRM1 P35372 1/20 0.53
SCN5A Q14524 1/20 0.53
SCN9A Q15858 1/20 0.53
SCN2A Q99250 1/20 0.53
SCN3A Q9NY46 1/20 0.53
SCN10A Q9Y5Y9 1/20 0.53

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
SCHEMBL5983429 0.80 PPARG (0.65) PPARGPPARAMAPT
SCHEMBL3973585 0.80 PPARG (0.65) PPARGPPARAMAPT
SCHEMBL3978007 0.78 PPARG (0.67) PPARGPPARA
SCHEMBL3974615 0.78 PPARG (0.68) PPARGPPARA
SCHEMBL20553475 0.78 PPARG (1.00) PPARGPPARA
SCHEMBL20553473 0.78 PPARG (1.00) PPARGPPARA
SCHEMBL5984622 0.77 PPARG (0.64) PPARGPPARA
SCHEMBL3974226 0.77 PPARG (0.64) PPARGPPARA
SCHEMBL3974606 0.77 PPARG (0.64) PPARGPPARA
SCHEMBL3972386 0.76 PPARG (0.56) PPARGPPARATP53MAPTRXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7534894-B2 Biphenyloxy-acids WYETH (US) 2009-05-19 US claimed
EP-1667959-A1 BIPHENYLOXY-ACIDS Wyeth (US) 2006-06-14 EP claimed
US-20060020003-A1 Biphenyloxy-acids WYETH (US) 2006-01-26 US claimed
WO-2005030702-A1 BIPHENYLOXY-ACIDS WYETH (US) 2005-04-07 WO claimed
US-7534894-B2 Biphenyloxy-acids WYETH (US) 2009-05-19 US disclosed
EP-1667959-A1 BIPHENYLOXY-ACIDS Wyeth (US) 2006-06-14 EP disclosed
US-20060020003-A1 Biphenyloxy-acids WYETH (US) 2006-01-26 US disclosed
WO-2005030702-A1 BIPHENYLOXY-ACIDS WYETH (US) 2005-04-07 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-20060020003-A1 Biphenyloxy-acids AHR, ARNT, NR1H4 PPARG 88/4885PPARA 30/4885PTPN1 1495/4885

“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.