Known targets — ChEMBL curated mechanism
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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.46 |
| ▸ | CNR2 | P34972 | 2/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.46 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.45 |
| ▸ | FAAH | O00519 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | THRB | P10828 | 2/20 | 0.45 |
| ▸ | ASAH2 | Q9NR71 | 1/20 | 0.45 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CETP | P11597 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2451374 | 0.90 | ALDH1A1 (0.53) | CNR2TRPV1DEGS1FAAHALDH1A1 | |
| SCHEMBL11262200 | 0.86 | LPAR3 (0.48) | LPAR3CNR2DEGS1FAAHALDH1A1 | |
| SCHEMBL6740155 | 0.82 | SLC6A5 (0.51) | CNR2FAAHALDH1A1CNR1 | |
| SCHEMBL11521076 | 0.80 | FAAH (0.51) | FAAHALDH1A1ASAH2MEN1KMT2A | |
| SCHEMBL23440261 | 0.80 | CNR1 (0.55) | CNR2TRPV1FAAHALDH1A1KCNK3 | |
| SCHEMBL2766930 | 0.78 | FABP3 (0.48) | FAAHBLMKMT2A | |
| SCHEMBL28921749 | 0.78 | FAAH (0.49) | FAAHALDH1A1ASAH2TP53MEN1 | |
| SCHEMBL1115275 | 0.78 | FAAH (0.49) | FAAHALDH1A1ASAH2TP53MEN1 | |
| SCHEMBL16611500 | 0.77 | SLC6A5 (0.48) | CNR2FAAHALDH1A1CNR1 | |
| SCHEMBL2763454 | 0.77 | MEN1 (0.41) | FAAHALDH1A1MEN1KMT2A |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1492864-B1 | FABRIC SOFTENER COMPOSITION AND METHODS FOR MANUFACTURING AND USING | ECOLAB INC (US) | 2011-09-14 | — | — | EP | claimed |
| US-20110218271-A1 | CREPING ADHESIVE MODIFIER AND PROCESS FOR PRODUCING PAPER PRODUCTS | GEORGIA-PACIFIC CONSUMER PRODUCTS LP (US) | 2011-09-08 | — | — | US | claimed |
| US-7959761-B2 | Using quaternary ammonium compound | GEORGIA-PACIFIC CONSUMER PRODUCTS LP (US) | 2011-06-14 | — | — | US | claimed |
| US-20040158939-A1 | Phase-separated rinse-off hair coloring/conditioning products | THE PROCTER & GAMBLE COMPANY | 2004-08-19 | — | — | US | claimed |
| EP-1292267-A2 | PHASE-SEPARATED RINSE-OFF HAIR COLORING/CONDITIONING PRODUCTS | THE PROCTER & GAMBLE COMPANY (US) | 2003-03-19 | — | — | EP | claimed |
| WO-2001078670-A2 | PHASE-SEPARATED RINSE-OFF HAIR COLORING/CONDITIONING PRODUCTS | THE PROCTER & GAMBLE COMPANY (US) | 2001-10-25 | — | — | WO | claimed |
| US-20160090557-A1 | SUBSTRATES COMPRISING MALODOR REDUCTION COMPOSITIONS | THE PROCTER & GAMBLE COMPANY | 2016-03-31 | — | — | US | disclosed |
| EP-1397478-B8 | WATER SOLUBLE PACKAGE AND LIQUID CONTENTS THEREOF | UNILEVER PLC (GB) | 2011-01-19 | — | — | EP | disclosed |
| EP-1399608-B1 | SPANDEX CONTAINING QUATERNARY AMINE ADDITIVES | INVISTA TECH SARL (US) | 2004-11-17 | — | — | EP | disclosed |
| US-20040158940-A1 | Phase-separated rinse-off hair coloring/cleansing products | THE PROCTER & GAMBLE COMPANY | 2004-08-19 | — | — | US | disclosed |
| EP-1276453-A2 | PHASE-SEPARATED RINSE-OFF HAIR COLORING/CLEANSING PRODUCTS | THE PROCTER & GAMBLE COMPANY (US) | 2003-01-22 | — | — | EP | disclosed |
| US-6403682-B1 | Spandex containing quaternary amine additives | E. I. DU PONT DE NEMOURS AND COMPANY | 2002-06-11 | — | — | US | disclosed |
| WO-2001078671-A2 | PHASE-SEPARATED RINSE-OFF HAIR COLORING/CLEANSING PRODUCTS | THE PROCTER & GAMBLE COMPANY (US) | 2001-10-25 | — | — | WO | disclosed |
| US-5668094-A | Fabric softening bar compositions containing fabric softener and enduring perfume | THE PROCTER & GAMBLE COMPANY (US) | 1997-09-16 | — | — | US | disclosed |
| US-5578234-A | QUATERNARY AMMONIUM COMPOUND, OXYALKYLATED SUGAR, TERTIARY AMINE SALT OF CARBOXYLIC ACID | THE PROCTER & GAMBLE COMPANY (US) | 1996-11-26 | — | — | US | disclosed |
| US-5476599-A | Containing a quaternary ammonium compound and a tertiary amine salt of a carboxylic acid | THE PROCTER & GAMBLE COMPANY (US) | 1995-12-19 | — | — | US | disclosed |
| US-4769159-A | Institutional softener containing cationic surfactant and organic acid | ECOLAB INC. (US) | 1988-09-06 | — | — | 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.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20040158939-A1 | Phase-separated rinse-off hair coloring/conditioning products | PLIN5, ALPG, CUTA | LPAR3 3535/4885CNR2 2582/4885TRPV1 714/4885 |
| US-20040158940-A1 | Phase-separated rinse-off hair coloring/cleansing products | POLR1C, SHH, ALPG | LPAR3 3291/4885CNR2 3619/4885TRPV1 2672/4885 |
“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.