SCHEMBL4424172

SCHEMBL4424172

CCCCCCCCCCCCC(O)C=O

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.61
DDAH1 O94760 1/20 0.61
GAPDH P04406 1/20 0.61
MAPT P10636 1/20 0.61
GPR84 Q9NQS5 8/20 0.50
FFAR1 O14842 2/20 0.50
FFAR4 Q5NUL3 1/20 0.50
ADH1B P00325 1/20 0.47
ADH1C P00326 1/20 0.47
ADH1A P07327 1/20 0.47
ADH4 P08319 1/20 0.47
ADH7 P40394 1/20 0.47
FDPS P14324 3/20 0.45
SPHK1 Q9NYA1 1/20 0.45

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
SCHEMBL5179720 1.00 TRPA1 (0.61) TRPA1DDAH1GAPDHMAPTGPR84
SCHEMBL7612717 1.00 TRPA1 (0.61) TRPA1DDAH1GAPDHMAPTGPR84
SCHEMBL5181161 1.00 TRPA1 (0.61) TRPA1DDAH1GAPDHMAPTGPR84
SCHEMBL4436993 1.00 TRPA1 (0.61) TRPA1DDAH1GAPDHMAPTGPR84
SCHEMBL4424265 1.00 TRPA1 (0.61) TRPA1DDAH1GAPDHMAPTGPR84
SCHEMBL23037444 1.00 TRPA1 (0.61) TRPA1DDAH1GAPDHMAPTGPR84
SCHEMBL4425883 1.00 TRPA1 (0.61) TRPA1DDAH1GAPDHMAPTGPR84
SCHEMBL7607320 1.00 TRPA1 (0.61) TRPA1DDAH1GAPDHMAPTGPR84
SCHEMBL3186133 1.00 TRPA1 (0.61) TRPA1DDAH1GAPDHMAPTGPR84
SCHEMBL3191386 1.00 TRPA1 (0.61) TRPA1DDAH1GAPDHMAPTGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109789065-B Cosmetic composition for combating colour loss of dyed material 因诺斯佩克有限公司 2023-11-21 CN claimed
CN-109789064-B Methods, compositions and uses related thereto 因诺斯佩克有限公司 2023-11-21 CN claimed
CN-109890360-B Methods, compositions and uses related thereto 因诺斯佩克有限公司 2023-11-21 CN claimed
CN-109310594-A Methods, compositions and uses related thereto 因诺斯佩克有限公司 2019-02-05 CN claimed
CN-109152710-A Methods, compositions and uses related thereto 因诺斯佩克有限公司 2019-01-04 CN claimed
CN-101434557-A Derivative of short chain 2-hydroxy carboxylic acid of ceramide COSMOFUMU CORP (NL) 2009-05-20 CN claimed
EP-1511500-A4 COMBINATION OF ANTI-MUSCARINIC AGENTS AND NON-GLUCOCORTICOID STEROIDS EPIGENESIS PHARMACEUTICALS LLC (US) 2009-04-29 EP claimed
JP-2006504666-A 2006-02-09 JP claimed
CN-1674918-A Compositions, formulations and kits for treating respiratory and pulmonary diseases using dehydroepiandrosterone steroids and antimuscarinic drugs EPIGENESIS PHARMACEUTICALS INC (US) 2005-09-28 CN claimed
EP-1511500-A2 COMBINATION OF ANTI-MUSCARINIC AGENTS AND NON-GLUCOCORTICOID STEROIDS Epigenesis Pharmaceuticals, Inc. (US) 2005-03-09 EP claimed
US-20030216329-A1 Composition, formulations & kit for treatment of respiratory & lung disease with dehydroepiandrosterone(s) steroid & an anti-muscarinic agent(s) EPEGENESIS PHARMACEUTICALS, INC. 2003-11-20 US claimed
US-6284750-B1 DRUG, COSMETICS STEROID ESTEE LAUDER INC. 2001-09-04 US claimed
EP-0876391-B1 NOVEL STEROID ESTERS USEFUL AGAINST SKIN DISORDERS ESTEE LAUDER INC (US) 2000-08-16 EP claimed
US-6025347-A Steroid esters useful against skin disorders ESTEE LAUDER INC. (US) 2000-02-15 US claimed
EP-0706509-B1 SHORT CHAIN 2-HYDROXYCARBOXYLIC ACID-BASED DERIVATIVES OF CERAMIDES DSM NV (NL) 2000-01-05 EP claimed
US-5948418-A MERCAPTANS ESTEE LAUDER, INC. (US) 1999-09-07 US claimed
EP-0876391-A4 NOVEL STEROID ESTERS USEFUL AGAINST SKIN DISORDERS ESTEE LAUDER INC (US) 1998-12-30 EP claimed
EP-0876391-A1 NOVEL STEROID ESTERS USEFUL AGAINST SKIN DISORDERS ESTEE LAUDER INC. (US) 1998-11-11 EP claimed
US-5683705-A Sulfur-based amides and bis-amides useful against skin disorders ESTEE LAUDER, INC. (US) 1997-11-04 US claimed
WO-1997010255-A1 NOVEL STEROID ESTERS USEFUL AGAINST SKIN DISORDERS ESTEE LAUDER, INC. (US) 1997-03-20 WO claimed

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-20030216329-A1 Composition, formulations & kit for treatment of respiratory & lung disease with dehydroepiandrosterone(s) steroid & an anti-muscarinic agent(s) KIT, NR5A1, CHRM5 TRPA1 4747/4885DDAH1 1929/4885GAPDH 1346/4885

“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.