SCHEMBL5113860

SCHEMBL5113860

CCn1nc(OCCCc2cc(COc3ccc(Cl)cc3Cl)cc(OC(C)C)c2)cc1CCC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 16/20 0.52
FFAR4 Q5NUL3 1/20 0.43
RAB9A P51151 1/20 0.40
P2RX3 P56373 1/20 0.39
FFAR1 O14842 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
SCHEMBL5109286 0.94 PPARG (0.56) PPARGFFAR4RAB9AP2RX3FFAR1
SCHEMBL5118952 0.91 PPARG (0.47) PPARGFFAR4RAB9AP2RX3FFAR1
SCHEMBL5112547 0.88 PPARG (0.46) PPARGFFAR4RAB9AP2RX3FFAR1
SCHEMBL5106677 0.84 PPARG (0.51) PPARGFFAR4RAB9AP2RX3FFAR1
SCHEMBL5107321 0.83 PPARG (0.59) PPARG
SCHEMBL5106954 0.82 PPARG (0.49) PPARGFFAR4RAB9AP2RX3FFAR1
SCHEMBL5111643 0.77 PPARG (0.59) PPARG
SCHEMBL5120342 0.76 FFAR4 (0.48) PPARGFFAR4P2RX3FFAR1
SCHEMBL5112150 0.74 PPARG (0.42) PPARG
SCHEMBL5110649 0.74 MRGPRX4 (0.50) FFAR4

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 52/4885FFAR4 91/4885RAB9A 3734/4885

“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.