SCHEMBL3435249

SCHEMBL3435249

CCCCCNCP(=O)(O)O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR2 O95136 8/20 0.64
S1PR1 P21453 8/20 0.64
S1PR3 Q99500 8/20 0.64
S1PR4 O95977 7/20 0.64
S1PR5 Q9H228 1/20 0.64
ANPEP P15144 1/20 0.56
ERAP2 Q6P179 1/20 0.56
ALDH1A1 P00352 1/20 0.52
TSHR P16473 1/20 0.52
LPAR3 Q9UBY5 3/20 0.48
LPAR2 Q9HBW0 1/20 0.48
FDPS P14324 4/20 0.45
FNTA P49354 1/20 0.43
FNTB P49356 1/20 0.43
EPHX1 P07099 1/20 0.43
ADH1B P00325 1/20 0.43
ADH1C P00326 1/20 0.43
ADH1A P07327 1/20 0.43
ADH4 P08319 1/20 0.43
ADH7 P40394 1/20 0.43

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
SCHEMBL5689613 0.98 S1PR2 (0.68) S1PR2S1PR1S1PR3S1PR4S1PR5
SCHEMBL10450203 0.98 S1PR2 (0.68) S1PR2S1PR1S1PR3S1PR4S1PR5
SCHEMBL10450207 0.98 S1PR2 (0.68) S1PR2S1PR1S1PR3S1PR4S1PR5
SCHEMBL10451801 0.98 S1PR2 (0.68) S1PR2S1PR1S1PR3S1PR4S1PR5
SCHEMBL9745419 0.98 S1PR2 (0.68) S1PR2S1PR1S1PR3S1PR4S1PR5
SCHEMBL5691575 0.98 S1PR2 (0.68) S1PR2S1PR1S1PR3S1PR4S1PR5
SCHEMBL5691935 0.98 S1PR2 (0.68) S1PR2S1PR1S1PR3S1PR4S1PR5
SCHEMBL9745857 0.93 S1PR2 (0.55) S1PR2S1PR1S1PR3S1PR4S1PR5
SCHEMBL5689630 0.90 S1PR2 (0.59) S1PR2S1PR1S1PR3S1PR4S1PR5
SCHEMBL21503939 0.84 S1PR2 (0.62) S1PR2S1PR1S1PR3S1PR4S1PR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1664068-A2 PROCESS FOR THE PREPARATION OF N-PHOSPHONO-METHYLGLYCINE AND DERIVATIVES THEREOF Monsanto Technology, LLC (US) 2006-06-07 EP claimed
US-20050054871-A1 Process for the preparation of N-phosphonomethylglycine and derivatives thereof MONSANTO TECHNOLOGY LLC 2005-03-10 US claimed
WO-2005019230-A2 PROCESS FOR THE PREPARATION OF N-PHOSPHONO-METHYLGLYCINE AND DERIVATIVES THEREOF MONSANTO TECHNOLOGY LLC (US) 2005-03-03 WO claimed
EP-0537786-B1 Preparation of N-acylaminomethylphosphonic acid SHOWA DENKO KK (JP) 1998-01-21 EP claimed
US-5453537-A Method for preparing an N-phosphonomethylglycine SHOWA DENKO K.K. (JP) 1995-09-26 US claimed
WO-1995013285-A1 PROCESS FOR THE PREPARATION OF PHOSPHOROUS ACID/CARBOXYLIC ACID MIXED ANHYDRIDES AND ANHYDROUS PHOSPHOROUS ACID E.I. DU PONT DE NEMOURS AND COMPANY (US) 1995-05-18 WO claimed
EP-0341233-B1 Process for the preparation of N-phosphonomethylglycine MONSANTO CO (US) 1995-03-22 EP claimed
US-5324855-A Mixing an N-methylolamide with phosphorus trihalide in aprotic solvent, in presence of water, heating, then adding more water, efficiency, simplification SHOWA DENKO K.K. (JP) 1994-06-28 US claimed
US-5233080-A Preparation of N-acylaminomethylphosphonic acids and aminomethylphosphonic acids E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-08-03 US claimed
EP-0537786-A1 Preparation of N-acylaminomethylphosphonic acid SHOWA DENKO KABUSHIKI KAISHA (JP) 1993-04-21 EP claimed
US-5041627-A Preparation of N-acyl-aminomethylphosphonates MONSANTO COMPANY (US) 1991-08-20 US claimed
EP-0370992-A2 Preparation of N-acyl-aminomethylphosphonates Monsanto Company (US) 1990-05-30 EP claimed
EP-0341233-A2 Process for the preparation of N-phosphonomethylglycine Monsanto Company (US) 1989-11-08 EP claimed
US-4851159-A Process for the preparation of N- phosphonomethylglycine MONSANTO COMPANY (US) 1989-07-25 US claimed
JP-5112588-A None JP disclosed
JP-1313487-A None JP disclosed
JP-5112586-A None JP disclosed
EP-0130008-B1 METHOD FOR PREPARATION OF N-PHOSPHONOMETHYLGLYCINE STAUFFER CHEMICAL COMPANY (US) 1987-09-09 EP disclosed
US-4261929-A ONE STEP, FROM PHOSPHOROUS ACID, A NITRILE AND FORMALDEHYDE OR THEREACTION PRODUCT OF THE LATTER TWO BENCKISER-KNAPSACK GMBH (DE) 1981-04-14 US disclosed
US-4261929-A ONE STEP, FROM PHOSPHOROUS ACID, A NITRILE AND FORMALDEHYDE OR THEREACTION PRODUCT OF THE LATTER TWO BENCKISER-KNAPSACK GMBH (DE) 1981-04-14 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 (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-20050054871-A1 Process for the preparation of N-phosphonomethylglycine and derivatives thereof PHOSPHO1, GNE, MPHOSPH6 S1PR2 2735/4885S1PR1 2405/4885S1PR3 2245/4885

“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.