Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL3663515

C=C(C(=O)OCCN)C(C)C.N

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.35
THRB P10828 1/20 0.33
GABRR1 P24046 2/20 0.30

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
SCHEMBL41031 0.98 TSHR (0.36) TSHRTHRBGABRR1
Hydrochloric Acid SCHEMBL2533776 0.96 TSHR (0.35) TSHRTHRBGABRR1
Chloromethane SCHEMBL543091 0.94 TSHR (0.34) TSHRTHRB
Acetic Acid SCHEMBL8433810 0.92 TSHR (0.37) TSHRTHRBGABRR1
Sulfuric Acid SCHEMBL5068577 0.91 TSHR (0.32) TSHRTHRB
Acrylic Acid SCHEMBL8037578 0.88 TSHR (0.34) TSHR
Acrylamide SCHEMBL9647386 0.88 TSHR (0.37) TSHR
SCHEMBL446080 0.86 TSHR (0.39) TSHRTHRB
SCHEMBL10794570 0.86 TSHR (0.30) TSHR
SCHEMBL13372705 0.86 TSHR (0.33) TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2227496-B1 CATIONIC BEATAINE PRECURSORS TO ZWITTERIONIC BETAINES HAVING CONTROLLED BIOLOGICAL PROPERTIES UNIV WASHINGTON (US) 2014-10-29 EP disclosed
US-8404224-B2 Cationic betaine precursors to zwitterionic betaines having controlled biological properties UNIVERSITY OF WASHINGTON (US) 2013-03-26 US disclosed
US-20130011363-A1 CATIONIC BETAINE PRECURSORS TO ZWITTERIONIC BETAINES HAVING CONTROLLED BIOLOGICAL PROPERTIES UNIVERSITY OF WASHINGTON (US) 2013-01-10 US disclosed
US-8268301-B2 For drug delivery or biodrug delivery; acrylic type monomers; hydrolyzable group is hydrolyzable to an anionic center to provide a zwitterionic polymer having the anionic center covalently coupled to the cationic center through the second linker UNIVERSITY OF WASHINGTON (US) 2012-09-18 US disclosed
EP-2227496-A1 CATIONIC BEATAINE PRECURSORS TO ZWITTERIONIC BETAINES HAVING CONTROLLED BIOLOGICAL PROPERTIES University of Washington (US) 2010-09-15 EP disclosed
US-20090156460-A1 CATIONIC BETAINE PRECURSORS TO ZWITTERIONIC BETAINES HAVING CONTROLLED BIOLOGICAL PROPERTIES UNIVERSITY OF WASHINGTON (US) 2009-06-18 US disclosed
WO-2009067562-A1 CATIONIC BEATAINE PRECURSORS TO ZWITTERIONIC BETAINES HAVING CONTROLLED BIOLOGICAL PROPERTIES UNIVERSITY OF WASHINGTON (US) 2009-05-28 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 (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-20090156460-A1 CATIONIC BETAINE PRECURSORS TO ZWITTERIONIC BETAINES HAVING CONTROLLED BIOLOGICAL PROPERTIES SLC6A12, BHMT, PHOSPHO1 TSHR 3743/4885THRB 947/4885GABRR1 1682/4885
US-20130011363-A1 CATIONIC BETAINE PRECURSORS TO ZWITTERIONIC BETAINES HAVING CONTROLLED BIOLOGICAL PROPERTIES SLC6A12, BHMT, PHOSPHO1 TSHR 3743/4885THRB 947/4885GABRR1 1682/4885

“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.