Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL2074263

C[C@@H]1CCC[C@@]2(C)CC[C@H]3[C@H](C)CC[C@@H](C[C@H]12)C3(C)C.N

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 1/20 0.39
CDK5R1 Q15078 1/20 0.39
NR1I3 Q14994 1/20 0.39
GRIN1 Q05586 3/20 0.34
GRIN2B Q13224 3/20 0.34
MBOAT4 Q96T53 2/20 0.32
RET P07949 1/20 0.30
MAPK14 Q16539 1/20 0.30
CAMK1D Q8IU85 1/20 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
SCHEMBL901326 0.98 CDK5 (0.40) CDK5CDK5R1NR1I3GRIN1GRIN2B
SCHEMBL332530 0.98 CDK5 (0.40) CDK5CDK5R1NR1I3GRIN1GRIN2B
SCHEMBL3825 0.98 CDK5 (0.40) CDK5CDK5R1NR1I3GRIN1GRIN2B
Water SCHEMBL1070875 0.97 CDK5 (0.39) CDK5CDK5R1NR1I3GRIN1GRIN2B
SCHEMBL789094 0.97 CDK5 (0.39) CDK5CDK5R1NR1I3GRIN1GRIN2B
SCHEMBL27882040 0.97 CDK5 (0.39) CDK5CDK5R1NR1I3GRIN1GRIN2B
Water SCHEMBL1888091 0.97 CDK5 (0.39) CDK5CDK5R1NR1I3GRIN1GRIN2B
Water SCHEMBL3935755 0.97 CDK5 (0.39) CDK5CDK5R1NR1I3GRIN1GRIN2B
Cyanide SCHEMBL28515924 0.94 CDK5 (0.38) CDK5CDK5R1NR1I3GRIN1GRIN2B
SCHEMBL17856475 0.92 NR1I3 (0.40) CDK5CDK5R1NR1I3GRIN1GRIN2B

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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1537094-B1 Methods for converting taxane amides to paclitaxel or other taxanes PHYTON HOLDINGS LLC (US) 2014-07-02 EP claimed
US-7605278-B2 Protecting the hydroxyl of a taxane amide; reducing the amide with a transition metalcompound; removing the metal; acidolysis to form a taxane amine salt in solution;adding solvent to solidify; convert the amine salt into paclitaxel or other taxanes NATURAL PHARMACEUTICALS, INC. (US) 2009-10-20 US claimed
EP-1599457-A4 METHOD AND COMPOSITION FOR PREPARING A COMPOUND USING A BENZOLATING AGENT ESSENTIALLY FREE OF RING CHLORINATION NATURAL PHARMACEUTICALS INC (US) 2008-05-07 EP claimed
US-20080051589-A1 Methods And Compositions For Converting Taxane Amides To Paclitaxel Or Other Taxanes NATURAL PHARMACEUTICALS, INC. (US) 2008-02-28 US claimed
US-20060035962-A1 Method and compositions for preparing a compound using a benzoylating agent essentially free of ring chlorination NATURAL PHARMACEUTICALS, INC. 2006-02-16 US claimed
EP-1599457-A2 METHOD AND COMPOSITION FOR PREPARING A COMPOUND USING A BENZOLATING AGENT ESSENTIALLY FREE OF RING CHLORINATION Natural Pharmaceuticals, Inc. (US) 2005-11-30 EP claimed
EP-1537094-A2 METHODS AND COMPOSITIONS FOR CONVERTING TAXANE AMIDES TO PACLITAXEL OR OTHER TAXANES Natural Pharmaceuticals, Inc. (US) 2005-06-08 EP claimed
WO-2004068930-A2 METHOD AND COMPOSITION FOR PREPARING A COMPOUND USING A BENZOLATING AGENT ESSENTIALLY FREE OF RING CHLORINATION NATURAL PHARMACEUTICALS INC. (US) 2004-08-19 WO claimed
WO-2004013096-A2 METHODS AND COMPOSITIONS FOR CONVERTING TAXANE AMIDES TO PACLITAXEL OR OTHER TAXANES NATURAL PHARMACEUTICALS INC. (US) 2004-02-12 WO claimed
CN-106580880-A Stable cabazitaxel particle redispersible system 深圳海王医药科技研究院有限公司 2017-04-26 CN disclosed
CN-104490797-A Multiphase-stable albumin conjunction type cabazitaxel SHENZHEN NEPTUNUS PHARMACEUTIC 2015-04-08 CN disclosed
EP-1537094-B1 Methods for converting taxane amides to paclitaxel or other taxanes PHYTON HOLDINGS LLC (US) 2014-07-02 EP disclosed
US-7906661-B2 Semi-synthetic conversion of paclitaxel to docetaxel CHATHAM BIOTEC, LIMITED (CA) 2011-03-15 US disclosed
US-7605278-B2 Protecting the hydroxyl of a taxane amide; reducing the amide with a transition metalcompound; removing the metal; acidolysis to form a taxane amine salt in solution;adding solvent to solidify; convert the amine salt into paclitaxel or other taxanes NATURAL PHARMACEUTICALS, INC. (US) 2009-10-20 US disclosed
WO-2004068930-A3 METHOD AND COMPOSITION FOR PREPARING A COMPOUND USING A BENZOLATING AGENT ESSENTIALLY FREE OF RING CHLORINATION NATURAL PHARMACEUTICALS INC (US) 2004-11-25 WO disclosed
WO-2004068930-A2 METHOD AND COMPOSITION FOR PREPARING A COMPOUND USING A BENZOLATING AGENT ESSENTIALLY FREE OF RING CHLORINATION NATURAL PHARMACEUTICALS INC. (US) 2004-08-19 WO disclosed
WO-2004068930-A2 METHOD AND COMPOSITION FOR PREPARING A COMPOUND USING A BENZOLATING AGENT ESSENTIALLY FREE OF RING CHLORINATION NATURAL PHARMACEUTICALS INC. (US) 2004-08-19 WO disclosed
WO-2004013096-A3 METHODS AND COMPOSITIONS FOR CONVERTING TAXANE AMIDES TO PACLITAXEL OR OTHER TAXANES NATURAL PHARMACEUTICALS INC (US) 2004-06-17 WO disclosed
WO-2004013096-A2 METHODS AND COMPOSITIONS FOR CONVERTING TAXANE AMIDES TO PACLITAXEL OR OTHER TAXANES NATURAL PHARMACEUTICALS INC. (US) 2004-02-12 WO disclosed
WO-2004013096-A2 METHODS AND COMPOSITIONS FOR CONVERTING TAXANE AMIDES TO PACLITAXEL OR OTHER TAXANES NATURAL PHARMACEUTICALS INC. (US) 2004-02-12 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 (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-20080051589-A1 Methods And Compositions For Converting Taxane Amides To Paclitaxel Or Other Taxanes CA1, CA3, TERT CDK5 1694/4885CDK5R1 2805/4885NR1I3 3417/4885

“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.