SCHEMBL19304553

SCHEMBL19304553

C=C(CO)C(=O)OCC.C=CC(=O)OCCCC

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.67
HPGD P15428 1/20 0.67
ALDH1A1 P00352 4/20 0.49
CYP3A4 P08684 1/20 0.49
ATM Q13315 1/20 0.47
HCAR2 Q8TDS4 3/20 0.42
TP53 P04637 2/20 0.41
HIF1A Q16665 2/20 0.41
HSD17B10 Q99714 1/20 0.41
THRB P10828 2/20 0.39
NPSR1 Q6W5P4 2/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
FAAH O00519 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
Acrylic Acid Methyl Ester SCHEMBL5528020 0.94 TSHR (0.59) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL6889051 0.94 TSHR (0.58) TSHRHPGDALDH1A1CYP3A4ATM
Acrylic Acid Methyl Ester SCHEMBL5530022 0.88 TSHR (0.63) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL28678582 0.85 TSHR (0.63) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL4352340 0.84 TSHR (0.71) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL1514927 0.84 TSHR (0.71) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL1582609 0.84 TSHR (0.61) TSHRHPGDALDH1A1CYP3A4ATM
Acrylic Acid Ethyl Ester SCHEMBL27812800 0.84 TSHR (0.88) TSHRHPGDALDH1A1CYP3A4ATM
Acrylic Acid Ethyl Ester SCHEMBL23796 0.84 TSHR (0.88) TSHRHPGDALDH1A1CYP3A4ATM
Acrylic Acid Ethyl Ester SCHEMBL10823318 0.84 TSHR (0.88) TSHRHPGDALDH1A1CYP3A4ATM

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-11801207-B2 Water-in-oil emulsion sunscreen cosmetic SHISEIDO COMPANY, LTD. (JP) 2023-10-31 US disclosed
EP-3213742-B1 WATER-IN-OIL EMULSION SUNSCREEN COSMETIC SHISEIDO CO LTD (JP) 2023-09-06 EP disclosed
CN-108366916-B Spray type sunscreen cosmetic 株式会社资生堂 2020-04-28 CN disclosed
US-20170333301-A1 WATER-IN-OIL EMULSION SUNSCREEN COSMETIC SHISEIDO COMPANY, LTD. (JP) 2017-11-23 US disclosed
EP-3213742-A1 WATER-IN-OIL EMULSION SUNSCREEN COSMETIC Shiseido Company Ltd. (JP) 2017-09-06 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 (2 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-11801207-B2 Water-in-oil emulsion sunscreen cosmetic TYR, CUTA, LBR TSHR 806/4885HPGD 2231/4885ALDH1A1 2965/4885
US-20170333301-A1 WATER-IN-OIL EMULSION SUNSCREEN COSMETIC TYR, CUTA, LBR TSHR 806/4885HPGD 2231/4885ALDH1A1 2965/4885

“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.