SCHEMBL3484445

SCHEMBL3484445

CC(C)(C)OC(=O)C(C)(C)Oc1cccc(Oc2ccccc2CBr)c1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC1A5 Q15758 2/20 0.40
RIPK1 Q13546 1/20 0.39
PPARA Q07869 5/20 0.37
PPARD Q03181 2/20 0.37
PPARG P37231 3/20 0.37
SLC6A2 P23975 3/20 0.36
SLC6A4 P31645 3/20 0.36
SLC6A3 Q01959 2/20 0.36
KDM4E B2RXH2 1/20 0.35
POLB P06746 1/20 0.35
MTNR1B P49286 1/20 0.35
FBP1 P09467 1/20 0.35
P2RX4 Q99571 3/20 0.34
MEN1 O00255 1/20 0.33
TSHR P16473 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL3484675 0.89 RIPK1 (0.41) SLC1A5RIPK1PPARAPPARGSLC6A2
SCHEMBL4040101 0.86 PPARA (0.48) SLC1A5RIPK1PPARAPPARDPPARG
SCHEMBL3484402 0.81 PPARG (0.44) PPARAPPARDPPARGPOLBMTNR1B
SCHEMBL3484748 0.78 PTGDR2 (0.37) PPARAPPARGSLC6A2SLC6A4SLC6A3
SCHEMBL6955048 0.75 SLC6A2 (0.50) RIPK1SLC6A2SLC6A4SLC6A3TSHR
SCHEMBL3483934 0.75 HTT (0.43) PPARAPPARDPPARGPOLBMTNR1B
SCHEMBL4041637 0.75 PPARG (0.54) RIPK1PPARAPPARDPPARGSLC6A2
SCHEMBL4576129 0.74 CYP1A2 (0.41) PPARAPPARGKDM4EFBP1MEN1
SCHEMBL30609812 0.74 CYP1A2 (0.41) PPARAPPARGKDM4EFBP1MEN1
SCHEMBL3484417 0.73 PPARA (0.40) PPARAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100004159-A1 SUBSTITUTED IMIDAZOLONE DERIVATIVES, PREPARATIONS AND USES GENFIT (FR) 2010-01-07 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 (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-20100004159-A1 SUBSTITUTED IMIDAZOLONE DERIVATIVES, PREPARATIONS AND USES IPO5, PPIP5K2, IPO4 SLC1A5 948/4885RIPK1 2544/4885PPARA 1045/4885

“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.