SCHEMBL169825

SCHEMBL169825

CCCCCNC(CC)N(C)C

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 6/20 0.42
ALDH1A1 P00352 2/20 0.40
TSHR P16473 1/20 0.40
ADH1B P00325 1/20 0.33
ADH1C P00326 1/20 0.33
ADH1A P07327 1/20 0.33
ADH4 P08319 1/20 0.33
ADH7 P40394 1/20 0.33
DNM1 Q05193 3/20 0.32
DNM2 P50570 2/20 0.32
KDM4E B2RXH2 1/20 0.32
S1PR2 O95136 5/20 0.31
S1PR4 O95977 5/20 0.31
S1PR1 P21453 5/20 0.31
S1PR3 Q99500 5/20 0.31
S1PR5 Q9H228 1/20 0.31

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
SCHEMBL22631540 0.98 EPHX1 (0.46) EPHX1ALDH1A1TSHRADH1BADH1C
SCHEMBL28459714 0.98 EPHX1 (0.46) EPHX1ALDH1A1TSHRADH1BADH1C
SCHEMBL28318346 0.98 EPHX1 (0.46) EPHX1ALDH1A1TSHRADH1BADH1C
SCHEMBL27443494 0.98 EPHX1 (0.46) EPHX1ALDH1A1TSHRADH1BADH1C
SCHEMBL19894618 0.98 EPHX1 (0.46) EPHX1ALDH1A1TSHRADH1BADH1C
SCHEMBL8410933 0.98 EPHX1 (0.46) EPHX1ALDH1A1TSHRADH1BADH1C
SCHEMBL2129584 0.98 EPHX1 (0.46) EPHX1ALDH1A1TSHRADH1BADH1C
Hydrochloric Acid SCHEMBL29020790 0.96 EPHX1 (0.44) EPHX1ALDH1A1TSHRADH1BADH1C
Water SCHEMBL28739412 0.96 EPHX1 (0.44) EPHX1ALDH1A1TSHRADH1BADH1C
Bromide SCHEMBL29068638 0.96 EPHX1 (0.44) EPHX1ALDH1A1TSHRADH1BADH1C

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 1436 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2983678-B1 ANTI-MICROBIAL COMPOSITION ARETEON PTE LTD (SG) 2019-01-02 EP claimed
EP-2794018-B1 SUBSTANCE FOR DYEING KERATIN FIBERS, CONTAINING CATIONIC ANTHRAQUINONE DYES AND ANIONIC POLYMERS HENKEL AG & CO KGAA (DE) 2018-03-07 EP claimed
EP-2313073-B1 NON-SULFATE MILD SURFACTANT SYSTEM FOR SKIN AND HAIR CLEANING HENKEL AG & CO KGAA (DE) 2017-12-06 EP claimed
EP-2925284-B1 DYE GLOSS AGENT WITH SPECIAL CATIONIC PIGMENTS, TENSIDES AND POLYMERS HENKEL AG & CO KGAA (DE) 2017-06-28 EP claimed
US-9492366-B2 Dye gloss agent with special cationic pigments, tensides and polymers HENKEL AG & CO. KGAA (DE) 2016-11-15 US claimed
US-20150257995-A1 DYE GLOSS AGENT WITH SPECIAL CATIONIC PIGMENTS, TENSIDES AND POLYMERS HENKEL AG & CO. KGAA (DE) 2015-09-17 US claimed
EP-2313072-B1 STRUCTURED COMPOSITION WITH OPTIMUM STORAGE STABILITY PROPERTIES HENKEL AG & CO KGAA (DE) 2014-08-20 EP claimed
EP-2314270-B1 Hair cleaning product HENKEL AG & CO KGAA (DE) 2013-07-03 EP claimed
US-20110139170-A1 NON-SULFATE MILD SURFACTANT SYSTEM FOR SKIN AND HAIR CLEANING HIPPE THOMAS 2011-06-16 US claimed
US-20110052735-A1 SHAMPOO WITH FRUIT JUICE AND/OR VEGETABLE JUICE HENKEL AG & CO. KGAA 2011-03-03 US claimed
US-20240238303-A1 LARGE-CONDUCTANCE POTASSIUM CHANNEL MODULATORS, COMPOSITIONS THEREOF, METHODS OF MANUFACTURING THEREOF, AND METHODS OF USE THEREOF ENALARE THERAPEUTICS INC (US) 2024-07-18 US disclosed
EP-4398863-A1 THERMO-SENSITIVE COMPOSITION AND METHOD FOR PREPARATION THEREOF BASF SE (DE) 2024-07-17 EP disclosed
US-20240226007-A1 NICOTINAMIDE ADENINE DINUCLEOTIDE (NAD) COMPOSITIONS, METHODS OF MANUFACTURING THEREOF, AND METHODS OF USE THEREOF Sovida Solutions Ltd. (GB) 2024-07-11 US disclosed
EP-4393581-A2 BIODEGRADABLE POLYUREA/POLYURETHANE MICROCAPSULES Symrise AG (DE) 2024-07-03 EP disclosed
EP-2277597-B2 Reductive colour removal HENKEL AG & CO KGAA (DE) 2024-06-26 EP disclosed
US-6045779-A COMPRISING WATER-BASED FOAM, ALKYL POLYGLYCOSIDE, CATIONIC, AMPHOTERIC, ZWITTERIONIC, ANIONIC AND NONIONIC POLYMER, AND VEGETABLE OIL HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2000-04-04 US disclosed
US-5939081-A THICKENING AN OIL-IN-WATER EMULSION BY ADDING A THICKENING AGENT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1999-08-17 US disclosed
US-5795978-A CONTAINING ALKYL OR ALKENL OLIGOGLYCOSIDE AND FATTY ALCOHOL;COSMETICS, DRUGS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1998-08-18 US disclosed
US-5371250-A Process for the preparation of pure aqueous betaine solutions HOECHST AKTIENGESELLSCHAFT (DE) 1994-12-06 US disclosed
US-5292942-A Continuous preparation of betaines in high yield, purity HOECHST AKTIENGESELLSCHAFT (DE) 1994-03-08 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 (4 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-20150257995-A1 DYE GLOSS AGENT WITH SPECIAL CATIONIC PIGMENTS, TENSIDES AND POLYMERS KRT18, H1-0, H1-10 EPHX1 4304/4885ALDH1A1 1334/4885TSHR 1737/4885
US-20110139170-A1 NON-SULFATE MILD SURFACTANT SYSTEM FOR SKIN AND HAIR CLEANING SGMS1, CUTA, SMURF1 EPHX1 3747/4885ALDH1A1 2085/4885TSHR 4225/4885
US-20240238303-A1 LARGE-CONDUCTANCE POTASSIUM CHANNEL MODULATORS, COMPOSITIONS THEREOF, METHODS OF MANUFACTURING THEREOF, AND METHODS OF USE THEREOF KCNN2, KCNN1, KCNN3 EPHX1 3054/4885ALDH1A1 1789/4885TSHR 3264/4885
US-20110052735-A1 SHAMPOO WITH FRUIT JUICE AND/OR VEGETABLE JUICE CASP6, ATP6V0C, PRUNE1 EPHX1 3410/4885ALDH1A1 2500/4885TSHR 3351/4885

“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.