SCHEMBL5458580

SCHEMBL5458580

C=C(C)C(=O)OCCOCCOCCOCCOCCCCCCCCCCCC

nearest known ligand 0.79

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.79
THRB P10828 2/20 0.65
CES2 O00748 2/20 0.52
HTT P42858 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPT P10636 1/20 0.50
POLB P06746 1/20 0.44
APEX1 P27695 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
NAAA Q02083 1/20 0.44
DGKA P23743 1/20 0.44
RAD52 P43351 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
EPHX1 P07099 1/20 0.42
PLA2G2C Q5R387 1/20 0.41
ALDH1A1 P00352 1/20 0.39
HCAR2 Q8TDS4 1/20 0.39

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
SCHEMBL874759 1.00 TSHR (0.79) TSHRTHRBCES2HTTMEN1
SCHEMBL19077762 1.00 TSHR (0.79) TSHRTHRBCES2HTTMEN1
SCHEMBL11114441 1.00 TSHR (0.79) TSHRTHRBCES2HTTMEN1
SCHEMBL19077763 1.00 TSHR (0.79) TSHRTHRBCES2HTTMEN1
SCHEMBL5454703 1.00 TSHR (0.79) TSHRTHRBCES2HTTMEN1
SCHEMBL19077765 1.00 TSHR (0.79) TSHRTHRBCES2HTTMEN1
SCHEMBL5455892 1.00 TSHR (0.79) TSHRTHRBCES2HTTMEN1
SCHEMBL874556 1.00 TSHR (0.79) TSHRTHRBCES2HTTMEN1
SCHEMBL2997982 1.00 TSHR (0.79) TSHRTHRBCES2HTTMEN1
SCHEMBL7641931 1.00 TSHR (0.79) TSHRTHRBCES2HTTMEN1

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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115243767-B Oil-in-water type emulsified cosmetic 花王株式会社 2024-07-16 CN claimed
EP-3554470-B1 COSMETIC COMPOSITIONS COMPRISING HYALURONIC ACID ELC MAN LLC (US) 2023-07-26 EP claimed
US-20230125112-A1 OIL-IN-WATER-TYPE EMULSIFIED COSMETIC MATERIAL KAO CORPORATION (JP) 2023-04-27 US claimed
EP-4115952-A1 OIL-IN-WATER-TYPE EMULSIFIED COSMETIC MATERIAL Kao Corporation (JP) 2023-01-11 EP claimed
US-12458613-B2 Methods suitable for the treatment of acne KENVUE BRANDS LLC (US) 2025-11-04 US disclosed
WO-2025127116-A1 AQUEOUS COMPOSITION FOR BODY 花王株式会社 2025-06-19 WO disclosed
US-20250195409-A1 METHODS FOR IMPROVING CUTANEOUS PERMEATION OF CANNABINOIDS AND FATTY ACID AMIDES Ananda Scientific, Inc. (US) 2025-06-19 US disclosed
US-20250152484-A1 OIL-IN-WATER EMULSION SKIN PREPARATION FOR EXTERNAL USE KAO CORPORATION (JP) 2025-05-15 US disclosed
US-20250032469-A1 TOPICAL COMPOSITION FOR ADMINISTRATION TO NAILS MIM PHARMA GMBH (DE) 2025-01-30 US disclosed
CN-114980858-B Oil-in-water type emulsified cosmetic 株式会社资生堂 2024-12-06 CN disclosed
EP-4470629-A1 OIL-IN-WATER EMULSION SKIN PREPARATION FOR EXTERNAL USE Kao Corporation (JP) 2024-12-04 EP disclosed
EP-4470526-A2 TOPICAL COMPOSITION FOR ADMINISTRATION TO NAILS MiM Pharma GmbH (DE) 2024-12-04 EP disclosed
US-11324676-B2 Hydrogen peroxide formulations in barrier layer films with a metalized layer HENKEL AG & CO. KGAA (DE) 2022-05-10 US disclosed
US-11311472-B2 Topical composition comprising crosslinked hyaluronic acid and a polyacrylate compound TEOXANE (CH) 2022-04-26 US disclosed
US-11291286-B2 Cosmetic compositions with a micro-mesh structure ELC MANAGEMENT LLC (US) 2022-04-05 US disclosed
US-20220047543-A1 METHODS AND COMPOSITIONS SUITABLE FOR THE TREATMENT OF ACNE KENVUE BRANDS LLC 2022-02-17 US disclosed
US-20220047536-A1 METHODS SUITABLE FOR DISRUPTING A BIOFILM, AND/OR KILLING BACTERIA CONTAINED IN A BIOFILM KENVUE BRANDS LLC 2022-02-17 US disclosed
US-9417522-B2 Photosensitive resin composition and method for producing resist pattern JSR CORPORATION (JP) 2016-08-16 US disclosed
US-20150185604-A1 PHOTOSENSITIVE RESIN COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN JSR CORPORATION (JP) 2015-07-02 US disclosed
US-20070231747-A1 Radiation-sensitive negative resin composition JSR CORPORATION (JP) 2007-10-04 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 (7 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-20220047543-A1 METHODS AND COMPOSITIONS SUITABLE FOR THE TREATMENT OF ACNE LGALS7; LGALS7B, MGAT3, ALG1 TSHR 3481/4885THRB 2358/4885CES2 3635/4885
US-20220047536-A1 METHODS SUITABLE FOR DISRUPTING A BIOFILM, AND/OR KILLING BACTERIA CONTAINED IN A BIOFILM HAO2, CUTA, HACL2 TSHR 2374/4885THRB 565/4885CES2 1151/4885
US-12458613-B2 Methods suitable for the treatment of acne CUTA, HSD17B12, HAO2 TSHR 1992/4885THRB 618/4885CES2 860/4885
US-11291286-B2 Cosmetic compositions with a micro-mesh structure CD44, CUTA, MSH6 TSHR 2549/4885THRB 3210/4885CES2 3573/4885
US-20250195409-A1 METHODS FOR IMPROVING CUTANEOUS PERMEATION OF CANNABINOIDS AND FATTY ACID AMIDES CNR2, CNR1, FAAH TSHR 3371/4885THRB 4002/4885CES2 158/4885
US-11311472-B2 Topical composition comprising crosslinked hyaluronic acid and a polyacrylate compound CUTA, CD44, COL14A1 TSHR 4632/4885THRB 4386/4885CES2 512/4885
US-20250152484-A1 OIL-IN-WATER EMULSION SKIN PREPARATION FOR EXTERNAL USE CUTA, NAPEPLD, LIPA TSHR 4317/4885THRB 4288/4885CES2 1150/4885

“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.