SCHEMBL3369325

SCHEMBL3369325

NCCN(C(CC(=O)[O-])C(=O)[O-])C(CC(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+].[Na+]

nearest known ligand 0.40

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA4 known ✓ P22748 2/20 0.40
CA2 known ✓ P00918 1/20 0.37
CA1 known ✓ P00915 1/20 0.30
CTSL P07711 1/20 0.34
CPT2 P23786 1/20 0.31
CPT1A P50416 1/20 0.31

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
SCHEMBL7874080 0.96 CA4 (0.37) CA4CA2CTSLCPT2CPT1A
SCHEMBL5794127 0.93 CA4 (0.35) CA4CA2CTSL
SCHEMBL17594649 0.93 CA4 (0.35) CA4CA2CTSL
SCHEMBL21862 0.72 CA4 (0.48) CA4CA2CTSLCPT2CPT1A
SCHEMBL6239313 0.69 CA4 (0.41) CA4CA2CTSL
SCHEMBL381960 0.68 CA4 (0.44) CA4CA2CTSL
SCHEMBL1997913 0.67 GABRR1 (0.38)
SCHEMBL10381476 0.67 CPB2 (0.41)
SCHEMBL7807211 0.67 GABRR1 (0.38)
SCHEMBL7132158 0.65 CA2 (0.48) CA4CA2CTSLCPT2CPT1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6384003-B1 SUBSTRATE IMPREGNATED WITH CLEANING COMPOUND COLGATE-PALMOLIVE COMPANY 2002-05-07 US claimed
US-11655411-B2 Thermochemical composition for well cleanup KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2023-05-23 US disclosed
US-11518925-B2 Downhole exothermic reaction well bore wall clean up method KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2022-12-06 US disclosed
US-20220220360-A1 WELL BORE WALL CLEAN UP METHOD KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2022-07-14 US disclosed
US-20220220361-A1 THERMOCHEMICAL COMPOSITION FOR WELL CLEANUP KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2022-07-14 US disclosed
US-11326090-B2 Combined thermochemical and chelating agents useful for well cleanup KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2022-05-10 US disclosed
US-20210115322-A1 COMBINED THERMOCHEMICAL AND CHELATING AGENTS USEFUL FOR WELL CLEANUP KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2021-04-22 US disclosed
US-10947483-B2 Encapsulates PROCTER & GAMBLE INTERNATIONAL OPERATIONS SA (CH) 2021-03-16 US disclosed
US-10604728-B2 Encapsulates PROCTER & GAMBLE INTERNATIONAL OPERATIONS SA (CH) 2020-03-31 US disclosed
US-20200071639-A1 Encapsulates PROCTER & GAMBLE INT OPERATIONS SA (CH) 2020-03-05 US disclosed
WO-2000002995-A1 SURFACTANT AGGLOMERATES THE PROCTER & GAMBLE COMPANY (US) 2000-01-20 WO disclosed
WO-2000002989-A1 SURFACTANT AGGLOMERATES THE PROCTER & GAMBLE COMPANY (US) 2000-01-20 WO disclosed
EP-0972826-A1 Process for producing a powder from a packaged tablet THE PROCTER & GAMBLE COMPANY (US) 2000-01-19 EP disclosed
EP-0972827-A1 Process for producing a powder from a tablet THE PROCTER & GAMBLE COMPANY (US) 2000-01-19 EP disclosed
EP-0971030-A1 Surfactant agglomerates THE PROCTER & GAMBLE COMPANY (US) 2000-01-12 EP disclosed
EP-0971028-A1 Detergent tablet with high dissolution and mechanical characteristics THE PROCTER & GAMBLE COMPANY (US) 2000-01-12 EP disclosed
EP-0971029-A1 Detergent tablet with high mechanical and dissolution characteristics THE PROCTER & GAMBLE COMPANY (US) 2000-01-12 EP disclosed
EP-0971023-A1 Surfactant agglomerates THE PROCTER & GAMBLE COMPANY (US) 2000-01-12 EP disclosed
EP-0949327-A1 Shape and strength of detergent tablets THE PROCTER & GAMBLE COMPANY (US) 1999-10-13 EP disclosed
WO-1999050381-A1 SHAPE AND STRENGTH OF DETERGENT TABLETS THE PROCTER & GAMBLE COMPANY (US) 1999-10-07 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 (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-20200071639-A1 Encapsulates LIPA, TTPA, CHMP4B CA4 2796/4885CA2 3928/4885CA1 3244/4885
US-10947483-B2 Encapsulates LIPA, TTPA, CHMP4B CA4 2796/4885CA2 3928/4885CA1 3244/4885

“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.