Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL2082802

CC(C)(N)c1ccccn1.N

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
NOS3 P29474 2/20 0.41
NOS1 P29475 2/20 0.41
NOS2 P35228 2/20 0.41
PI4KA P42356 1/20 0.41
PI4K2B Q8TCG2 1/20 0.41
PI4K2A Q9BTU6 1/20 0.41
PI4KB Q9UBF8 1/20 0.41
CHRM2 P08172 2/20 0.40
KDM4E B2RXH2 3/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
POLB P06746 1/20 0.39
CCR1 P32246 1/20 0.39
CCR5 P51681 1/20 0.39
CCR8 P51685 1/20 0.39
METAP1 P53582 1/20 0.39
BLM P54132 1/20 0.39
HIF1A Q16665 1/20 0.39

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
SCHEMBL1114414 0.98 SMN1; SMN2 (0.54) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
SCHEMBL29435883 0.98 SMN1; SMN2 (0.54) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
Hydrochloric Acid SCHEMBL21810899 0.95 SMN1; SMN2 (0.52) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
Hydrochloric Acid SCHEMBL19814625 0.95 SMN1; SMN2 (0.52) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
SCHEMBL1921572 0.84 SMN1; SMN2 (0.54) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
Hydrochloric Acid SCHEMBL15353020 0.82 SMN1; SMN2 (0.52) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
Ammonia Solution, Strong SCHEMBL7412270 0.81 SMN1; SMN2 (0.56) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
SCHEMBL10442032 0.80 SMN1; SMN2 (0.61) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
SCHEMBL27615166 0.80 SMN1; SMN2 (0.50) SMN1; SMN2L3MBTL1NOS3NOS1NOS2
Ammonia Solution, Strong SCHEMBL16042040 0.79 SMN1; SMN2 (0.45) SMN1; SMN2L3MBTL1NOS3NOS1NOS2

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-1613613-B1 CXCR4 CHEMOKINE RECEPTOR BINDING COMPOUNDS GENZYME CORP (US) 2021-06-02 EP disclosed
US-7863293-B2 CXCR4 chemokine receptor binding compounds GENZYME CORPORATION (US) 2011-01-04 US disclosed
US-20080255197-A1 CXCR4 CHEMOKINE RECEPTOR BINDING COMPOUNDS ANORMED CORPORATION (CA) 2008-10-16 US disclosed
US-7291631-B2 CXCR4 chemokine receptor binding compounds GENZYME CORPORATION (US) 2007-11-06 US disclosed
US-20040209921-A1 CXCR4 chemokine receptor binding comounds ANORMED CORPORATION (CA) 2004-10-21 US 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-20040209921-A1 CXCR4 chemokine receptor binding comounds CXCR4, CXCR1, CXCR3 SMN1; SMN2 4611/4885L3MBTL1 2244/4885NOS3 1323/4885
US-20080255197-A1 CXCR4 CHEMOKINE RECEPTOR BINDING COMPOUNDS CXCR4, CXCR1, CXCR3 SMN1; SMN2 4601/4885L3MBTL1 2510/4885NOS3 2350/4885

“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.