SCHEMBL13853209

SCHEMBL13853209

C=CC(=O)OC(COc1ccc(Oc2ccccc2)cc1)COc1cccc(OCOc2ccc(Oc3ccccc3)cc2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 1/20 0.45
HTR1B P28222 1/20 0.45
THRB P10828 1/20 0.44
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ATM Q13315 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
GLA P06280 1/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
TGM2 P21980 1/20 0.40
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
LTA4H P09960 1/20 0.38
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
SCHEMBL14546502 0.96 HTR1D (0.48) HTR1DHTR1BTHRBKDM4EALDH1A1
SCHEMBL13853202 0.92 THRB (0.43) HTR1DHTR1BTHRBL3MBTL1KMT2A
SCHEMBL11957662 0.91 THRB (0.51) HTR1DHTR1BTHRBKDM4EALDH1A1
SCHEMBL19944468 0.91 THRB (0.51) HTR1DHTR1BTHRBSMN1; SMN2GLA
SCHEMBL13853204 0.88 PTPN7 (0.43) THRBKDM4EALDH1A1MEN1KMT2A
SCHEMBL4194694 0.88 THRB (0.46) HTR1DHTR1BTHRBL3MBTL1KMT2A
SCHEMBL4202683 0.87 THRB (0.48) THRBSMN1; SMN2GLAGAAHTT
SCHEMBL13853210 0.87 THRB (0.48) THRBSMN1; SMN2GLAGAAHTT
SCHEMBL5088322 0.85 THRB (0.57) THRBKDM4EALDH1A1MEN1KMT2A
SCHEMBL4202631 0.85 THRB (0.46) THRBFFAR1FFAR4

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-7534909-B2 (Meth) acrylic ester compound and use thereof MITSUI CHEMICALS, INC. (JP) 2009-05-19 US disclosed
US-20070078198-A1 (Meth) acrylic ester compound and use thereof MITSUI CHEMICALS, INC. (JP) 2007-04-05 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-20070078198-A1 (Meth) acrylic ester compound and use thereof METTL14, PAM, TAS2R41 HTR1D 643/4885HTR1B 1011/4885THRB 1009/4885

“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.