SCHEMBL5111033

SCHEMBL5111033

CCCOc1cc(CCCO)n(Cc2ccccc2OC)n1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.43
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
PKM P14618 1/20 0.39
PDE5A O76074 1/20 0.38
TLR7 Q9NYK1 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
GAA P10253 1/20 0.38
PTGER1 P34995 1/20 0.38
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
CYP2C19 P33261 1/20 0.36
FPR1 P21462 1/20 0.36
LMNA P02545 1/20 0.35
NPSR1 Q6W5P4 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
SCHEMBL5113441 0.83 PPARG (0.54) PPARGMEN1KMT2APKMALDH1A1
SCHEMBL5110194 0.83 CYP11B1 (0.43) PPARGPDE5ASMN1; SMN2PTGER1KDM4E
SCHEMBL5113074 0.83 PPARG (0.64) PPARGMEN1KMT2APKMPDE5A
SCHEMBL5120054 0.83 KDM4E (0.44) PPARGMEN1KMT2APKMPTGER1
SCHEMBL5119912 0.80 PPARG (0.42) PPARGSMN1; SMN2PTGER1KDM4EALDH1A1
SCHEMBL5112056 0.78 PPARG (0.61) PPARG
SCHEMBL5121178 0.77 PPARG (0.46) PPARGGAAALDH1A1NPSR1
SCHEMBL5114575 0.77 CYSLTR1 (0.45) PPARGMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL5105537 0.76 PPARG (0.64) PPARGPTGER1
SCHEMBL5113068 0.74 PPARG (0.39) PPARG

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 52/4885MEN1 4517/4885KMT2A 2478/4885

“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.