SCHEMBL5113595

SCHEMBL5113595

CC(C)Oc1ccc(CCCOc2nn(C)cc2CC(=O)O)c(Oc2ncc(Cl)cc2Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
P2RX3 P56373 2/20 0.39
ACACB O00763 1/20 0.39
LIPE Q05469 4/20 0.37
BCHE P06276 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
CYP2C9 P11712 1/20 0.36
TSHR P16473 1/20 0.36
APEX1 P27695 1/20 0.36
MAPK1 P28482 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
SCHEMBL5110500 0.91 PPARG (0.45) PPARGL3MBTL1P2RX3ACACBLIPE
SCHEMBL5120370 0.90 PPARG (0.58) PPARGSMN1; SMN2LMNA
SCHEMBL5112219 0.89 PPARG (0.43) PPARGL3MBTL1P2RX3ACACBLIPE
SCHEMBL5113115 0.86 PPARG (0.46) PPARGP2RX3SMN1; SMN2LMNA
SCHEMBL5107810 0.85 PPARG (0.45) PPARGL3MBTL1ACACBLIPEBCHE
SCHEMBL5113771 0.82 PPARG (0.59) PPARGL3MBTL1ACACBLIPEBCHE
SCHEMBL5120082 0.82 PPARG (0.61) PPARGSMN1; SMN2
SCHEMBL5113868 0.82 PPARG (0.54) PPARGSMN1; SMN2
SCHEMBL5109443 0.81 PPARG (0.58) PPARGSMN1; SMN2
SCHEMBL5120850 0.81 PPARG (0.47) PPARGL3MBTL1ACACBLIPEBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080051418-A1 Arylalkanoic Acid Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-02-28 US disclosed
EP-1829863-A1 ARYLALKANOIC ACID DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2007-09-05 EP 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-20080051418-A1 Arylalkanoic Acid Derivative INSR, NPY1R, GPR119 PPARG 52/4885L3MBTL1 2694/4885P2RX3 746/4885

“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.