SCHEMBL5107645

SCHEMBL5107645

CC(C)c1nn(Cc2ccc(Cl)cc2Cl)cc1CCCOc1cc(CCC(=O)O)n(-c2ccccc2)n1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 17/20 0.51
FABP3 P05413 1/20 0.38
SNCA P37840 1/20 0.38
P2RX7 Q99572 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL5120333 0.87 PPARG (0.47) PPARGFABP3SNCAP2RX7
SCHEMBL5108668 0.82 PPARG (0.76) PPARG
SCHEMBL5105830 0.79 PPARG (0.52) PPARGFABP3
SCHEMBL5114674 0.77 PPARG (0.54) PPARG
SCHEMBL5120057 0.77 PPARG (0.51) PPARGFABP3SNCA
SCHEMBL5113087 0.74 TLR8 (0.42) PPARGALDH1A1SMN1; SMN2
SCHEMBL5109148 0.74 PPARG (0.80) PPARG
SCHEMBL6035849 0.73 MLYCD (0.36) PPARGFABP3SNCA
SCHEMBL5115463 0.73 PPARG (0.46) PPARGFABP3SNCA
SCHEMBL5120044 0.73 PPARG (0.41) PPARGP2RX7ALDH1A1SMN1; SMN2

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 52/4885FABP3 1103/4885SNCA 2770/4885

“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.