SCHEMBL3494565

SCHEMBL3494565

O=Cc1ccc(COCCO)s1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 1/20 0.37
ADRA1A P35348 1/20 0.37
ADRA1B P35368 1/20 0.37
ALDH1A1 P00352 1/20 0.34
DPP4 P27487 1/20 0.31
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL16901842 0.83 ALDH1A1 (0.41) ADRA1DADRA1AADRA1BALDH1A1DPP4
SCHEMBL16901841 0.79 DPP4 (0.45) ADRA1DADRA1AADRA1BALDH1A1DPP4
SCHEMBL3229983 0.76 ALDH1A1 (0.39) ADRA1DADRA1AADRA1BALDH1A1DPP4
SCHEMBL8185448 0.75
SCHEMBL9900205 0.74 ADRA1D (0.43) ADRA1DADRA1AADRA1BALDH1A1DPP4
SCHEMBL16901837 0.73 ALDH1A1 (0.37) ADRA1DADRA1AADRA1BALDH1A1DPP4
SCHEMBL19434555 0.69 MRGPRX4 (0.51) ALDH1A1TSHRMAPK1
SCHEMBL7130916 0.68 MAPT (0.39) ADRA1DADRA1AADRA1BALDH1A1DPP4
SCHEMBL12664443 0.67 ALDH1A1 (0.41) ADRA1DADRA1AADRA1BALDH1A1DPP4
SCHEMBL3176922 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100081652-A1 Cinnamoyl Compound and Use Thereof SHIRAKI HIROAKI 2010-04-01 US disclosed
US-20100081652-A1 Cinnamoyl Compound and Use Thereof SHIRAKI HIROAKI 2010-04-01 US disclosed
US-20100081652-A1 Cinnamoyl Compound and Use Thereof SHIRAKI HIROAKI 2010-04-01 US disclosed
EP-1857455-A1 CINNAMOYL COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2007-11-21 EP disclosed
EP-1857455-A1 CINNAMOYL COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2007-11-21 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-20100081652-A1 Cinnamoyl Compound and Use Thereof COL2A1, MMP7, COL14A1 ADRA1D 4229/4885ADRA1A 4067/4885ADRA1B 2939/4885

“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.