Xylometazoline

Xylometazoline

SCHEMBL871223

Cc1cc(C(C)(C)C)cc(C)c1CC1=NCCN1.[Cl-].[H+]

nearest known ligand 0.97

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2C

The experimentally established mechanism targets of Xylometazoline. 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
ADRA2A known ✓ P08913 7/20 0.97
ADRA2B known ✓ P18089 6/20 0.97
ADRA2C known ✓ P18825 6/20 0.97
ADRA1D known ✓ P25100 5/20 0.97
ADRA1A known ✓ P35348 5/20 0.97
ADRA1B known ✓ P35368 5/20 0.97
HTR1D P28221 12/20 0.97
HTR1B P28222 10/20 0.97
HTR1A P08908 4/20 0.97
LMNA P02545 3/20 0.97
CYP2D6 P10635 3/20 0.97
TSHR P16473 3/20 0.97
CHRM2 P08172 2/20 0.97
CHRM1 P11229 2/20 0.97
HTR2A P28223 2/20 0.97
HTR2C P28335 2/20 0.97
DRD3 P35462 2/20 0.97
HTR2B P41595 2/20 0.97
TP53 P04637 1/20 0.97
DRD2 P14416 1/20 0.97

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
Xylometazoline SCHEMBL34087 0.98 HTR1D (1.00) HTR1DHTR1BADRA2AADRA2BADRA2C
Xylometazoline SCHEMBL3300993 0.97 HTR1D (0.97) HTR1DHTR1BADRA2AADRA2BADRA2C
Xylometazoline SCHEMBL41837 0.97 HTR1A (1.00) HTR1DHTR1BADRA2AADRA2BADRA2C
Xylometazoline SCHEMBL3297417 0.97 HTR1D (0.97) HTR1DHTR1BADRA2AADRA2BADRA2C
Xylometazoline SCHEMBL3299510 0.97 HTR1D (0.97) HTR1DHTR1BADRA2AADRA2BADRA2C
Xylometazoline SCHEMBL6436975 0.95 HTR1A (0.97) HTR1DHTR1BADRA2AADRA2BADRA2C
Xylometazoline SCHEMBL3300203 0.90 HTR1D (0.84) HTR1DHTR1BADRA2AADRA2BADRA2C
Xylometazoline SCHEMBL3304354 0.90 HTR1D (0.84) HTR1DHTR1BADRA2AADRA2BADRA2C
Xylometazoline SCHEMBL3301402 0.90 HTR1D (0.84) HTR1DHTR1BADRA2AADRA2BADRA2C
SCHEMBL8149986 0.89 HTR1D (1.00) HTR1DHTR1BADRA2AADRA2BADRA2C

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-107249566-A A kind of nasal composition that stability is improved using seawater as excipient 加德兰-盖林斯基实验室有限责任公司 2017-10-13 CN claimed
CN-103351343-A Synthetic method for xylometazoline hydrochloride TIANJIN HUAJIN PHARMACEUTICAL CO LTD 2013-10-16 CN claimed
US-20220000909-A1 A NASAL SOLUTION WITH CLOSED BASIN NATURAL SPRING WATER CHARACTERISTIC AND METHOD FOR OBTAINING SAID NASAL SOLUTION YILDIZ TEKNIK UNIVERSITESI (TR) 2022-01-06 US disclosed
EP-3886812-A1 A NASAL SOLUTION WITH CLOSED BASIN NATURAL SPRING WATER CHARACTERISTIC AND METHOD FOR OBTAINING SAID NASAL SOLUTION Yildiz Teknik Universitesi (TR) 2021-10-06 EP disclosed
WO-2020112063-A1 A NASAL SOLUTION WITH CLOSED BASIN NATURAL SPRING WATER CHARACTERISTIC AND METHOD FOR OBTAINING SAID NASAL SOLUTION YILDIZ TEKNIK UNIVERSITESI (TR) 2020-06-04 WO disclosed
EP-2376074-B1 METHOD FOR IMPROVED BIOACTIVATION OF MEDICATIONS DRITTE PATENTPORTFOLIO BETEILI (DE) 2019-03-13 EP disclosed
CN-107249566-A A kind of nasal composition that stability is improved using seawater as excipient 加德兰-盖林斯基实验室有限责任公司 2017-10-13 CN disclosed
CN-103351343-A Synthetic method for xylometazoline hydrochloride TIANJIN HUAJIN PHARMACEUTICAL CO LTD 2013-10-16 CN disclosed
CN-101928247-B Synthetic method of xylometazoline hydrochloride compound WUHAN WUYAO TECHNOLOGY CO LTD 2012-05-09 CN disclosed
US-20120077876-A1 Method For Improved Bioactivation Of Pharmaceuticals DRITTE PATENTPORTFOLIO BETEILIGUNGSGESELLSCHAFT MBH & CO. KG (DE) 2012-03-29 US disclosed
CN-101928247-A Method for synthesizing xylometazoline hydrochloride compound WUHAN WUYAO TECHNOLOGY CO LTD 2010-12-29 CN disclosed
CN-1290502-C Compositions for treatment of common cold NYCOMED DANMARK AS (DK) 2006-12-20 CN disclosed
CN-1555263-A Compositions for treatment of common cold ο 2004-12-15 CN 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 (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-20120077876-A1 Method For Improved Bioactivation Of Pharmaceuticals CYP2B6, CYP1A2, CYP2D6 ADRA2A 331/4885ADRA2B 201/4885ADRA2C 297/4885

“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.