SCHEMBL19409848

SCHEMBL19409848

CCCCCCCCCCCCCCCCCC(=O)C(C)(C(=O)CCCCCCCCCCCCCCCCC)C(C)(N)O.COS(=O)(=O)O

nearest known ligand 0.42

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 11/20 0.42
▸ CES1 P23141 10/20 0.42
▸ CES2 O00748 5/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ CA12 O43570 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA7 P43166 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ CA14 Q9ULX7 1/20 0.38
▸ GPR84 Q9NQS5 2/20 0.35
▸ PPARG P37231 2/20 0.35
▸ PPARD Q03181 2/20 0.35
▸ PPARA Q07869 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ SLC22A6 Q4U2R8 1/20 0.35
▸ SLC22A8 Q8TCC7 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
SCHEMBL28646473 1.00 FAAH (0.42) FAAHCES1CES2MEN1CYP1A2
SCHEMBL29286403 0.92 FAAH (0.50) FAAHCES1MEN1CYP1A2KMT2A
Sulfuric Acid SCHEMBL29078533 0.91 FAAH (0.47) FAAHCES1CES2MEN1CYP1A2
SCHEMBL455073 0.87 FAAH (0.53) FAAHCES1CES2MEN1CYP1A2
SCHEMBL2410991 0.87 FAAH (0.53) FAAHCES1CES2MEN1CYP1A2
SCHEMBL28363537 0.86 FAAH (0.46) FAAHCES1CES2MEN1CYP1A2
Hydrochloric Acid SCHEMBL16538159 0.85 FAAH (0.52) FAAHCES1CES2MEN1CYP1A2
SCHEMBL28498503 0.85 FAAH (0.40) FAAHCES1CES2MEN1CYP1A2
SCHEMBL28334153 0.85 FAAH (0.40) FAAHCES1CES2MEN1CYP1A2
SCHEMBL28336601 0.80 FAAH (0.43) FAAHCES1CES2MEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115074467-A Leather tanning process, anionic active agent composition, use of cationic active agents for the pre-tanning of leather and tanned leather 施华团队股份公司 2022-09-20 — — CN claimed
CN-114599334-A Stable low pH personal care compositions and methods therefor 高露洁-棕榄公司 2022-06-07 — — CN claimed
CN-115243663-A Composition for caring for keratin materials and use thereof 莱雅公司 2022-10-25 — — CN disclosed
CN-115074467-A Leather tanning process, anionic active agent composition, use of cationic active agents for the pre-tanning of leather and tanned leather 施华团队股份公司 2022-09-20 — — CN disclosed
CN-114901249-A Composition for conditioning keratin materials 莱雅公司 2022-08-12 — — CN disclosed
CN-114828814-A Composition for conditioning keratin materials 莱雅公司 2022-07-29 — — CN disclosed
CN-107412005-B Composition for dyeing keratin fibers 莱雅公司 2021-10-01 — — CN disclosed
CN-107750153-B Compositions and methods for treating hair 欧莱雅 2021-09-03 — — CN disclosed
US-10603262-B2 Cosmetic composition for use on hair and containing an acyl basic amino acid derivative AJINOMOTO CO., INC. (JP) 2020-03-31 — — US disclosed
CN-110944669-A Novel antifungal composition 拜奥科斯梅斯有限公司 2020-03-31 — — CN disclosed
EP-3238701-B1 COSMETIC COMPOSITION FOR USE ON HAIR AND CONTAINING AN ACYL BASIC AMINO ACID DERIVATIVE AJINOMOTO KK (JP) 2020-02-19 — — EP disclosed
EP-3238701-A1 COSMETIC COMPOSITION FOR USE ON HAIR AND CONTAINING AN ACYL BASIC AMINO ACID DERIVATIVE AJINOMOTO CO., INC. (JP) 2017-11-01 — — EP disclosed
US-20170281494-A1 COSMETIC COMPOSITION FOR USE ON HAIR AND CONTAINING AN ACYL BASIC AMINO ACID DERIVATIVE AJINOMOTO CO., INC. (JP) 2017-10-05 — — 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-20170281494-A1 COSMETIC COMPOSITION FOR USE ON HAIR AND CONTAINING AN ACYL BASIC AMINO ACID DERIVATIVE CUTA, TRPA1, NACA FAAH 288/4885CES1 4604/4885CES2 3326/4885
US-10603262-B2 Cosmetic composition for use on hair and containing an acyl basic amino acid derivative CUTA, TRPA1, NACA FAAH 288/4885CES1 4604/4885CES2 3326/4885

“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.

Send feedback