Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL6555178

N.O=C(O)CC(O)CC(O)CO

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.57
LMNA P02545 3/20 0.48
GABRR1 P24046 2/20 0.48
MAPT P10636 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.40
GPR84 Q9NQS5 4/20 0.39
ALDH1A1 P00352 1/20 0.38
OR51E2 Q9H255 1/20 0.36
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
MMP12 P39900 1/20 0.32
MMP13 P45452 1/20 0.32
MMP14 P50281 1/20 0.32
USP2 O75604 1/20 0.32
CYP3A4 P08684 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
Ammonia Solution, Strong SCHEMBL6555061 1.00 SLC22A6 (0.57) SLC22A6LMNAGABRR1MAPTTDP1
SCHEMBL1135908 0.97 SLC22A6 (0.60) SLC22A6LMNAGABRR1MAPTTDP1
SCHEMBL4671010 0.97 SLC22A6 (0.60) SLC22A6LMNAGABRR1MAPTTDP1
SCHEMBL6557026 0.97 SLC22A6 (0.60) SLC22A6LMNAGABRR1MAPTTDP1
SCHEMBL6453593 0.87 SLC22A6 (0.75) SLC22A6LMNAGABRR1MAPTTDP1
SCHEMBL3447372 0.84
SCHEMBL415844 0.84
SCHEMBL415845 0.84
SCHEMBL7465733 0.81
SCHEMBL7465718 0.81

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
EP-1184380-B1 Ammonium 3,5,6-trihydroxyhexanoate derivatives and preparation process thereof TAKASAGO PERFUMERY CO LTD (JP) 2004-02-25 EP disclosed
US-20020052515-A1 Ammonium 3,5,6-trihydroxyhexanoate derivatives and preparation process thereof TAKASAGO INTERNATIONAL CORPORATION 2002-05-02 US disclosed
US-6365755-B1 REACTING 3,5,6-TRIHYDROXYHEXANOIC ACID WITH AN AMINE THEN PURIFYING THE RESULTING AMMONIUM COMPOUND BY CRYSTALLIZATION; CHEMICAL INTERMEDIATES FOR HMG-COA REDUCTASE INHIBITOR; STABILITY; PREFERENTIAL STEREOCONFIGURATION TAKASAGO INTERNATIONAL CORPORATION (JP) 2002-04-02 US disclosed
JP-2002069069-A DERIVATIVE OF 3,5,6-TRIHYDROXYHEXANOIC ACID AMMONIUM SALT AND METHOD OF PREPARING THE SAME TAKASAGO INTERNATL CORP 2002-03-08 JP disclosed
EP-1184380-A1 Ammonium 3,5,6-trihydroxyhexanoate derivatives and preparation process thereof Takasago International Corporation (JP) 2002-03-06 EP 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-20020052515-A1 Ammonium 3,5,6-trihydroxyhexanoate derivatives and preparation process thereof ABHD5, ALKBH3, APEH SLC22A6 2714/4885LMNA 4459/4885GABRR1 1371/4885

“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.