SCHEMBL1123056

SCHEMBL1123056

O=C(NC(Cc1c[nH]c2ccc(Br)cc12)C(=O)O)c1ccc(OCCN(Cc2ccccc2)Cc2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.54
ITGB2 P05107 5/20 0.54
ICAM1 P05362 5/20 0.54
ITGAL P20701 5/20 0.54
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
ADAM17 P78536 1/20 0.49
ERAP2 Q6P179 1/20 0.49
PTPN1 P18031 1/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA9 Q16790 1/20 0.47
P2RY14 Q15391 1/20 0.47
LNPEP Q9UIQ6 1/20 0.46
POLB P06746 1/20 0.46
HTT P42858 1/20 0.46
MRGPRX4 Q96LA9 1/20 0.45
FPR2 P25090 1/20 0.45

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
SCHEMBL1122981 0.92 ITGB2 (0.52) PPARGITGB2ICAM1ITGALMEN1
SCHEMBL1123375 0.90 PPARG (0.65) PPARGITGB2ICAM1ITGALMEN1
SCHEMBL1122929 0.90 PPARG (0.59) PPARGITGB2ICAM1ITGALMEN1
SCHEMBL1122844 0.84 MEN1 (0.63) PPARGMEN1KMT2AADAM17ERAP2
SCHEMBL1122892 0.83 PPARG (0.56) PPARGMEN1KMT2AADAM17ERAP2
SCHEMBL1123437 0.83 PTPN1 (0.67) PPARGPTPN1CA12CA1CA9
SCHEMBL28757743 0.81 ITGB2 (0.51) PPARGITGB2ICAM1ITGALMEN1
SCHEMBL1122913 0.78 PTPN1 (0.56) PPARGKMT2APTPN1CA12CA1
SCHEMBL1122887 0.78 TACR1 (0.54) PPARGMEN1KMT2AADAM17ERAP2
SCHEMBL27659071 0.77 ERAP2 (0.59) PPARGITGB2ICAM1ITGALMEN1

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-1644321-B1 NEW BENZAMIDES AS PPATY MODULATORS S A L V A T LAB SA (ES) 2011-02-09 EP disclosed
CN-1835914-A New benzamides as PPAR[upsilon] modulators S A L V A T LAB SA (ES) 2006-09-20 CN disclosed
US-20060160894-A1 Benzamides as ppar modulators LABORATORIOS S.A.L.V.A.T.,S.A. (ES) 2006-07-20 US disclosed
EP-1644321-A2 NEW BENZAMIDES AS PPATY MODULATORS LABORATORIOS S.A.L.V.A.T., S.A. (ES) 2006-04-12 EP disclosed
WO-2004110983-A2 NEW BENZAMIDES AS PPARϒ MODULATORS LABORATORIOS S.A.L.V.A.T., S.A. (ES) 2004-12-23 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-20060160894-A1 Benzamides as ppar modulators PPARD, PPARA, PPARG PPARG 3/4885ITGB2 2389/4885ICAM1 3103/4885

“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.