SCHEMBL3741541

SCHEMBL3741541

CC(CO)CC(=O)OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
MAPK1 P28482 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
SLC15A1 P46059 2/20 0.55
MMP9 P14780 1/20 0.48
TDP1 Q9NUW8 2/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
KMT2A Q03164 1/20 0.47
CDC25B P30305 1/20 0.47
ABCB1 P08183 1/20 0.45
TSHR P16473 1/20 0.45
LMNA P02545 2/20 0.44
HCAR2 Q8TDS4 1/20 0.44
ATM Q13315 1/20 0.43

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
SCHEMBL10047602 1.00 ALDH1A1 (0.56) ALDH1A1MAPK1L3MBTL1SLC15A1MMP9
SCHEMBL31246157 0.87 ALDH1A1 (0.53) ALDH1A1MAPK1L3MBTL1SLC15A1MMP9
SCHEMBL19007853 0.87 ALDH1A1 (0.56) ALDH1A1MAPK1L3MBTL1SLC15A1MMP9
SCHEMBL14959576 0.87 ALDH1A1 (0.56) ALDH1A1MAPK1L3MBTL1SLC15A1MMP9
SCHEMBL20793265 0.87 ALDH1A1 (0.56) ALDH1A1MAPK1L3MBTL1SLC15A1MMP9
SCHEMBL30884891 0.86 SLC15A1 (0.49) ALDH1A1MAPK1L3MBTL1SLC15A1MMP9
SCHEMBL7365728 0.85 SLC15A1 (0.57) ALDH1A1MAPK1L3MBTL1SLC15A1MMP9
SCHEMBL111390 0.84 ALDH1A1 (0.61) ALDH1A1MAPK1L3MBTL1SLC15A1MMP9
SCHEMBL7140669 0.84 ALDH1A1 (0.53) ALDH1A1MAPK1L3MBTL1SLC15A1TDP1
SCHEMBL7406398 0.83 ALDH1A1 (0.59) ALDH1A1MAPK1L3MBTL1SLC15A1MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8357662-B2 Surface-based ammonium ion sensor and methods of making thereof WORCESTER POLYTECHNIC INSTITUTE (US) 2013-01-22 US disclosed
US-20100290951-A1 SURFACE-BASED AMMONIUM ION SENSOR: AN ELECTRODE DERIVATIZED WITH A SELF-ASSEMBLED MONOLAYER WORCESTER POLYTECHNIC INSITUTE (US) 2010-11-18 US disclosed
WO-2008031091-A2 A SURFACE-BASED AMMONIUM ION SENSOR: AN ELECTRODE DERIVATIZED WITH A SELF-ASSEMBLED MONOLAYER WORCESTER POLYTECHNIC INSTITUTE (US) 2008-03-13 WO 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-20100290951-A1 SURFACE-BASED AMMONIUM ION SENSOR: AN ELECTRODE DERIVATIZED WITH A SELF-ASSEMBLED MONOLAYER DNMT3A, ACMSD, CD4 ALDH1A1 2016/4885MAPK1 3044/4885L3MBTL1 3528/4885

“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.