SCHEMBL2237706

SCHEMBL2237706

C=C(C)C(=O)OCC(CCCCCCCCCCCCCCCCCC)N(C)C

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.54
ZDHHC7 Q9NXF8 1/20 0.38
THRB P10828 2/20 0.37
THRA P10827 1/20 0.37
FAAH O00519 1/20 0.37
GPR84 Q9NQS5 3/20 0.35
FFAR1 O14842 1/20 0.35
MAPT P10636 2/20 0.34
LCK P06239 1/20 0.34
PPARD Q03181 1/20 0.34
ZDHHC20 Q5W0Z9 1/20 0.34
ZDHHC2 Q9UIJ5 1/20 0.34
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34
CNR1 P21554 1/20 0.34

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
SCHEMBL2161342 0.87 TSHR (0.52) TSHRTHRB
SCHEMBL27621466 0.87 TSHR (0.61) TSHRZDHHC7THRBFAAHGPR84
Bromide SCHEMBL1324362 0.85 TSHR (0.59) TSHRZDHHC7THRBFAAHGPR84
Bromide SCHEMBL6023579 0.85 TSHR (0.59) TSHRZDHHC7THRBFAAHGPR84
Hydrochloric Acid SCHEMBL1547471 0.85 TSHR (0.59) TSHRZDHHC7THRBFAAHGPR84
SCHEMBL30572507 0.83 ZDHHC7 (0.38) TSHRZDHHC7GPR84FFAR1MAPT
SCHEMBL13779875 0.82 TSHR (0.61) TSHRTHRB
SCHEMBL1616017 0.81 TSHR (0.42) TSHRTHRB
SCHEMBL7082106 0.81 TSHR (0.61) TSHRZDHHC7THRBFAAHGPR84
SCHEMBL17941650 0.81 TSHR (0.61) TSHRZDHHC7THRBFAAHGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115023217-B Hair treatment compositions, kits and methods of use 莱雅公司 2024-12-06 CN disclosed
CN-118546559-A Aqueous formulation comprising at least one aqueous hydrophobing agent for producing an aqueous coating composition with improved early rain resistance 赢创运营有限公司 2024-08-27 CN disclosed
CN-117956966-A Solid personal care compositions incorporating natural benefit agents such as linseed oil and methods therefor 高露洁-棕榄公司 2024-04-30 CN disclosed
EP-3516029-B1 FRAGRANCE PELLETS COMPOSED OF SOLIDS-CONTAINING MELT DISPERSIONS HENKEL AG & CO KGAA (DE) 2023-06-07 EP disclosed
EP-3728540-A1 PRODUCING A MELTABLE OBJECT CONTAINING A PERFUME Henkel AG & Co. KGaA (DE) 2020-10-28 EP disclosed
US-10030217-B2 Solid textile care and/or skincare composition HENKEL AG & CO. KGAA (DE) 2018-07-24 US disclosed
US-8518867-B2 Solid textile and/or skin care composition HENKEL AG & CO. KGAA (DE) 2013-08-27 US disclosed
US-7989412-B2 Solid textile care composition based on soap HENKEL AG & CO. KGAA (DE) 2011-08-02 US disclosed
US-20090281011-A1 Solid Textile Care And/Or Skincare Composition HENKEL AG & CO. KGAA (DE) 2009-11-12 US disclosed
US-20090099055-A1 Solid Textile Care Composition Based On Soap HENKEL AG & CO. KGAA (DE) 2009-04-16 US disclosed
US-20090082244-A1 Solid Textile And/Or Skin Care Composition HENKEL AG & C0. KGAA (DE) 2009-03-26 US disclosed
US-5958397-A TOPICALLY APPLYING A POLYMERIC QUATERNARY AMMONIUM SALT TO PROTECT AGAINST RUPTURE OF JELLYFISH NEMATOCYSTS; ARTICLES COMPRISING THE POLYMERIC QUATERNARY AMMONIUM SALT PACKAGED WITH LABEL INDICATING PROTECTION AGAINST JELLYFISH STINGS SCHERING-PLOUGH HEALTHCARE PRODUCTS, INC. (US) 1999-09-28 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 (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-20090281011-A1 Solid Textile Care And/Or Skincare Composition CUTA, SMARCC2, SMARCC1 TSHR 3723/4885ZDHHC7 1394/4885THRB 4157/4885
US-10030217-B2 Solid textile care and/or skincare composition CUTA, SMARCC2, SMARCC1 TSHR 3723/4885ZDHHC7 1394/4885THRB 4157/4885

“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.