SCHEMBL3047522

SCHEMBL3047522

CC[n+]1ccccc1.COS(=O)(=O)[O-]

nearest known ligand 0.37

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
CHRM1 known ✓ P11229 2/20 0.33
ACHE known ✓ P22303 2/20 0.33
CHRM3 known ✓ P20309 1/20 0.32
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 3/20 0.36
ALDH1A1 P00352 2/20 0.36
RAB9A P51151 2/20 0.36
POLB P06746 1/20 0.36
HPGD P15428 1/20 0.36
RAD52 P43351 2/20 0.35
PSMD14 O00487 1/20 0.35
SLC6A2 P23975 3/20 0.33
SLC6A4 P31645 3/20 0.33
SLC6A3 Q01959 3/20 0.33
CHRM2 P08172 2/20 0.33
ADRA2A P08913 2/20 0.33
ADORA3 P0DMS8 2/20 0.33
HTR1A P08908 2/20 0.33
ADRA1A P35348 2/20 0.33

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
Sulfuric Acid SCHEMBL17102611 0.87 ACHE (0.38) MAPTLMNARAD52SLC6A2SLC6A4
Sulfuric Acid SCHEMBL2866733 0.85 ACHE (0.37) MAPTLMNARAD52SLC6A2SLC6A4
SCHEMBL1293165 0.85 ACHE (0.37) MAPTLMNARAD52SLC6A2SLC6A4
SCHEMBL5085627 0.84 KMT2A (0.33) MAPTKDM4ELMNAALDH1A1RAB9A
SCHEMBL15941575 0.83 ACHE (0.35) MAPTLMNARAD52SLC6A2SLC6A4
Sulfuric Acid SCHEMBL2866735 0.83 KMT2A (0.36) MAPTLMNAALDH1A1RAD52SLC6A2
SCHEMBL2761089 0.81 ACHE (0.55) MAPTLMNARAD52SLC6A2SLC6A4
SCHEMBL11738230 0.80 BCHE (0.37) ACHE
SCHEMBL11741630 0.79 BCHE (0.35) MAPTKDM4ELMNAALDH1A1POLB
SCHEMBL562558 0.78 LMNA (0.42) MAPTKDM4ELMNAALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119677831-A Washing composition with reduced palm kernel dependence 联合利华知识产权控股有限公司 2025-03-21 CN disclosed
US-20100222580-A1 Process For The Preparation Of Onium Alkylsulfates Having A Low Halide Content MERCK PATENT GMBH (DE) 2010-09-02 US disclosed
EP-1828142-B1 METHOD FOR PRODUCING ONIUM ALKYL SULFATES WITH A LOW HALOGENIDE CONTENT MERCK PATENT GMBH (DE) 2010-06-02 EP disclosed
EP-1828142-A1 METHOD FOR PRODUCING ONIUM ALKYL SULFATES WITH A LOW HALOGENIDE CONTENT Merck Patent GmbH (DE) 2007-09-05 EP disclosed
WO-2006063654-A1 METHOD FOR PRODUCING ONIUM ALKYL SULFATES WITH A LOW HALOGENIDE CONTENT MERCK PATENT GMBH (DE) 2006-06-22 WO 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-20100222580-A1 Process For The Preparation Of Onium Alkylsulfates Having A Low Halide Content STS, MRPS35, ARSA CHRM1 4452/4885ACHE 3513/4885CHRM3 4246/4885

“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.