Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL4613751

N.O=C(O)[CH]CCS(=O)(=O)O

nearest known ligand 0.38

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Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.38
PDE4A P27815 1/20 0.38
LMNA P02545 1/20 0.38
SLC6A6 P31641 1/20 0.38
CYP2C19 P33261 1/20 0.38
BLM P54132 1/20 0.38
APP P05067 1/20 0.35
APEX1 P27695 1/20 0.31
EPHX2 P34913 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
SCHEMBL1697139 0.97 PTGS1 (0.39) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL6635415 0.82 APP (0.44) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL6631085 0.80 EPHX2 (0.43) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL6633963 0.78 EPHX2 (0.46) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL2467911 0.75 BLM (0.42) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL5425489 0.73 PTGS1 (0.33) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL7697611 0.73 TSHR (0.40) LMNABLMAPEX1
Fumaric Acid SCHEMBL6235895 0.72 TSHR (0.53) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL3795027 0.71 PTGS1 (0.45) PTGS1PDE4ALMNASLC6A6CYP2C19
Ammonia Solution, Strong SCHEMBL5050824 0.70 CD81 (0.36) PTGS1PDE4ALMNASLC6A6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1169405-B1 QUATERNARY NITROGEN CONTAINING AMPHOTERIC WATER SOLUBLE POLYMERS AND THEIR USE IN DRILLING FLUIDS AKZO NOBEL NV (NL) 2008-02-27 EP claimed
EP-1169405-A2 QUATERNARY NITROGEN CONTAINING AMPHOTERIC WATER SOLUBLE POLYMERS AND THEIR USE IN DRILLING FLUIDS Akzo Nobel N.V. (NL) 2002-01-09 EP claimed
US-6281172-B1 RHEOLOGICAL CONTROL AGENT AKZO NOBEL NV (NL) 2001-08-28 US claimed
WO-2000060023-A2 QUATERNARY NITROGEN CONTAINING AMPHOTERIC WATER SOLUBLE POLYMERS AND THEIR USE IN DRILLING FLUIDS AKZO NOBEL N.V. (NL) 2000-10-12 WO claimed