SCHEMBL4026049

SCHEMBL4026049

CCO[C@H](CO)Cc1ccc(OCCc2ccc(CC)cn2)cc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.50
CYP3A4 P08684 1/20 0.49
RXRA P19793 1/20 0.49
PPARA Q07869 8/20 0.42
HRH3 Q9Y5N1 1/20 0.38
PPARD Q03181 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
MCHR1 Q99705 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL6818157 0.85 PPARA (0.52) PPARGCYP3A4PPARAPPARDMEN1
SCHEMBL2361274 0.81 PPARA (0.61) PPARGPPARAPPARD
SCHEMBL2332479 0.81 PPARA (0.61) PPARGPPARAPPARD
SCHEMBL2332774 0.81 PPARA (0.61) PPARGPPARAPPARD
SCHEMBL6813922 0.81 PPARA (0.53) PPARGCYP3A4PPARAPPARDMEN1
SCHEMBL4026047 0.80 PPARG (0.51) PPARGCYP3A4RXRAPPARAHRH3
SCHEMBL4026050 0.79 PPARG (0.48) PPARGCYP3A4RXRAPPARAHRH3
SCHEMBL14213074 0.79 PPARG (0.52) PPARGCYP3A4RXRAHRH3CYP1A2
SCHEMBL7633878 0.78 PPARG (0.56) PPARGCYP3A4RXRAHRH3CYP1A2
SCHEMBL4028204 0.78 PPARG (0.52) PPARGPPARAPPARDMEN1LMNA

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-1569916-B1 SUBSTITUTED ARALKYL DERIVATIVES CADILA HEALTHCARE LTD (IN) 2009-01-07 EP claimed
US-20060142277-A1 Substituted aralkyl derivatives CADILA HEALTHCARE LIMITED 2006-06-29 US claimed
US-20090275565-A1 Substituted aralkyl derivatives CADILA HEALTHCARE LIMITED (IN) 2009-11-05 US disclosed
EP-1569916-B1 SUBSTITUTED ARALKYL DERIVATIVES CADILA HEALTHCARE LTD (IN) 2009-01-07 EP disclosed
US-20060142277-A1 Substituted aralkyl derivatives CADILA HEALTHCARE LIMITED 2006-06-29 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-20060142277-A1 Substituted aralkyl derivatives UGT1A7, UGT1A10, UGT2B7 PPARG 2043/4885CYP3A4 50/4885RXRA 1713/4885
US-20090275565-A1 Substituted aralkyl derivatives UGT1A7, UGT1A10, UGT2B7 PPARG 2043/4885CYP3A4 50/4885RXRA 1713/4885

“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.