Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL4046361

C[C@@H]1CCC[C@H](C)N1CCCl.N

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.37
HRH3 Q9Y5N1 2/20 0.34
HRH2 P25021 1/20 0.34
HRH1 P35367 1/20 0.34
MAOB P27338 1/20 0.34
ACHE P22303 1/20 0.33
KCNH2 Q12809 1/20 0.32
SIGMAR1 Q99720 1/20 0.32

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
SCHEMBL5483250 0.98 LTA4H (0.38) LTA4HHRH3HRH2HRH1MAOB
SCHEMBL4052146 0.98 LTA4H (0.38) LTA4HHRH3HRH2HRH1MAOB
Hydrochloric Acid SCHEMBL2585028 0.95 LTA4H (0.37) LTA4HHRH3HRH2HRH1MAOB
Hydrochloric Acid SCHEMBL10761360 0.95 LTA4H (0.37) LTA4HHRH3HRH2HRH1MAOB
Hydrochloric Acid SCHEMBL2968545 0.85 HRH2 (0.31) HRH3HRH2HRH1
Hydrochloric Acid SCHEMBL4444394 0.85 HRH2 (0.31) HRH3HRH2HRH1
SCHEMBL10370873 0.84 HRH3 (0.43) LTA4HHRH3HRH2HRH1MAOB
SCHEMBL3275933 0.84 HRH3 (0.43) LTA4HHRH3HRH2HRH1MAOB
Hydrochloric Acid SCHEMBL11613952 0.82 HRH3 (0.42) LTA4HHRH3HRH2HRH1MAOB
Hydrochloric Acid SCHEMBL2884926 0.82 HRH3 (0.42) LTA4HHRH3HRH2HRH1MAOB

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-1689720-B1 PYRAZOLYL DERIVATIVES IN THE FORM OF DRUGS FOR TREATING ACUTE OR CHRONIC NEURONAL REGRESSIONS AVENTIS PHARMA SA (FR) 2009-04-15 EP disclosed
EP-1689720-A1 PYRAZOLYL DERIVATIVES IN THE FORM OF DRUGS FOR TREATING ACUTE OR CHRONIC NEURONAL REGRESSIONS Aventis Pharma S.A. (FR) 2006-08-16 EP disclosed
WO-2005051917-A9 PYRAZOLYL DERIVATIVES IN THE FORM OF DRUGS FOR TREATING ACUTE OR CHRONIC NEURONAL REGRESSIONS AVENTIS PHARMA SA (FR) 2005-09-29 WO disclosed
WO-2005051917-A1 PYRAZOLYL DERIVATIVES IN THE FORM OF DRUGS FOR TREATING ACUTE OR CHRONIC NEURONAL REGRESSIONS AVENTIS PHARMA S.A. (FR) 2005-06-09 WO disclosed