Sugi Predict

Sugi Predict / Compounds / SCHEMBL6790942

SCHEMBL6790942

SCHEMBL6790942

NC(=O)NC(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 7/20 0.42
▸ MMP2 P08253 5/20 0.42
▸ CA14 Q9ULX7 1/20 0.42
▸ CA4 P22748 1/20 0.38
▸ CA9 Q16790 3/20 0.33
▸ CA2 P00918 3/20 0.33
▸ CA1 P00915 3/20 0.33
▸ MMP8 P22894 3/20 0.33
▸ TSHR P16473 2/20 0.33
▸ NFKB1 P19838 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ MMP9 P14780 2/20 0.33
▸ MMP1 P03956 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ THPO P40225 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CA5A P35218 1/20 0.33
▸ BLM P54132 1/20 0.33

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
SCHEMBL11142494 0.80 MMP2 (0.35) CA12MMP2CA14CA4CA9
SCHEMBL8809885 0.76 CA12 (0.36) CA12MMP2CA14CA4CA9
SCHEMBL11540685 0.72 CA12 (0.42) CA12MMP2CA14CA9CA2
SCHEMBL8336668 0.72 CA12 (0.42) CA12MMP2CA14CA9CA2
SCHEMBL22590166 0.72 CTSC (0.41) CA12MMP2CA14CA4CA2
SCHEMBL8768803 0.69 ALDH1A1 (0.31) TSHR
SCHEMBL4635288 0.69 ALDH1A1 (0.37) CA12MMP2CA14CA4CA9
SCHEMBL11695059 0.69 LAP3 (0.43) CA12MMP2CA9CA2CA1
SCHEMBL11766709 0.69 MMP2 (0.39) CA12MMP2CA14CA4CA9
SCHEMBL11656666 0.67 CYP2C9 (0.46) CA12MMP2CA14CA4CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2001511810-A — — 2001-08-14 — — JP claimed
US-6153753-A CATALYTIC CARBOXYMETHYLATION OF A CARBAMOYL COMPOUND BY PREMIXING THE CARBAMOYL COMPOUND AND THE CARBOXYMETHYLATION CATALYST PRECURSOR FIRST, THEN ADDING THE WATER AND ALDEHYDE; FORMING N-(PHOSPHONOMETHYL)GLYCINE HERBICIDE OR PESTICIDE MONSANTO COMPANY (US) 2000-11-28 — — US claimed
EP-0973719-A4 METHOD OF PREPARING AMINO CARBOXYLIC ACIDS MONSANTO CO (US) 2000-05-17 — — EP claimed
EP-0973719-A1 METHOD OF PREPARING AMINO CARBOXYLIC ACIDS MONSANTO COMPANY (US) 2000-01-26 — — EP claimed
WO-1998035930-A1 METHOD OF PREPARING AMINO CARBOXYLIC ACIDS MONSANTO COMPANY (US) 1998-08-20 — — WO claimed
US-6759549-B2 PREPARATION OF N-(PHOSPHONOMETHYL)GLYCINE, ITS SALTS, AND ITS ESTERS, WHEREIN THE METHOD OF PREPARATION COMPRISES A CARBOXYMETHYLATION STEP MONSANTO TECHNOLOGY LLC 2004-07-06 — — US disclosed
US-20030225298-A1 Method of preparing amino carboxylic acids MONSANTO TECHNOLOGY LLC 2003-12-04 — — US disclosed
US-20030088122-A1 Method of preparing amino carboxylic acids JOHNSON TODD J (US) 2003-05-08 — — US disclosed
US-20020058834-A1 Preparation of N-acyl amino carboxylic acids, amino carboxylic acids and their derivatives by metal-catalyzed carboxymethylation in the presence of a promoter MONSANTO TECHNOLOGY LLC 2002-05-16 — — US disclosed
US-20020002281-A1 Method of preparing amino carboxylic acids JOHNSON TODD J (US) 2002-01-03 — — US disclosed
WO-2001092208-A1 METAL-CATALYSED CARBOXYMETHYLATION IN THE PRESENCE OF A PROMOTER MONSANTO TECHNOLOGY LLC (US) 2001-12-06 — — WO disclosed
US-6265605-B1 ADDITIVE IN PROCESSED MEAT, BEVERAGES, AND IN OTHER PROCESSED FOOD STUFFS; AS INTERMEDIATES IN DRUGS, AGRICULTURAL CHEMICALS AND PESTICIDES, HERBICIDES MONSANTO COMPANY 2001-07-24 — — US disclosed
EP-0973719-A1 METHOD OF PREPARING AMINO CARBOXYLIC ACIDS MONSANTO COMPANY (US) 2000-01-26 — — EP disclosed
WO-1998035930-A1 METHOD OF PREPARING AMINO CARBOXYLIC ACIDS MONSANTO COMPANY (US) 1998-08-20 — — WO disclosed
EP-0693074-B1 PROCESS FOR THE MANUFACTURE OF AMINOMETHANEPHOSPHONIC ACID ZENECA LTD (GB) 1997-07-23 — — EP disclosed
EP-0693074-A1 PROCESS FOR THE MANUFACTURE OF AMINOMETHANEPHOSPHONIC ACID ZENECA LTD (GB) 1996-01-24 — — EP disclosed
US-5471000-A Process for the manufacture of aminomethanephosphonic acid ZENECA LIMITED (GB) 1995-11-28 — — US disclosed
WO-1994022880-A1 PROCESS FOR THE MANUFACTURE OF AMINOMETHANEPHOSPHONIC ACID ZENECA LIMITED (GB) 1994-10-13 — — WO disclosed
EP-0010147-B1 N,N'-DIALKYL-UREIDOMETHANE-DIPHOSPHONIC ACID, ITS PREPARATION AND USE Joh. A. Benckiser GmbH (DE) 1981-06-10 — — EP disclosed
EP-0010147-A1 N,N'-dialkyl-ureidomethane-diphosphonic acid, its preparation and use Joh. A. Benckiser GmbH (DE) 1980-04-30 — — 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 (4 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-20020002281-A1 Method of preparing amino carboxylic acids CPS1, GNMT, HNMT CA12 990/4885MMP2 3910/4885CA14 715/4885
US-20030088122-A1 Method of preparing amino carboxylic acids CPS1, GNMT, HNMT CA12 990/4885MMP2 3910/4885CA14 715/4885
US-20020058834-A1 Preparation of N-acyl amino carboxylic acids, amino carboxylic acids and their derivatives by metal-catalyzed carboxymethylation in the presence of a promoter BCAT2, GNMT, BCAT1 CA12 52/4885MMP2 1251/4885CA14 65/4885
US-20030225298-A1 Method of preparing amino carboxylic acids CPS1, GNMT, HNMT CA12 990/4885MMP2 3910/4885CA14 715/4885

“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.