SCHEMBL2037352

SCHEMBL2037352

CCCCCCCCCCCCCCN(CC)[C@@H](CC)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 2/20 0.43
GPR84 Q9NQS5 6/20 0.41
FFAR1 O14842 2/20 0.41
PPARD Q03181 6/20 0.40
MAPT P10636 1/20 0.40
LCK P06239 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
GRIK1 P39086 1/20 0.39
GRIK2 Q13002 1/20 0.39
CA2 P00918 1/20 0.38
MAPK1 P28482 1/20 0.38
ACE2 Q9BYF1 1/20 0.38
PPARG P37231 5/20 0.38
PPARA Q07869 5/20 0.38
HDAC11 Q96DB2 4/20 0.38
TSHR P16473 3/20 0.38
ALDH1A1 P00352 2/20 0.38
TLR2 O60603 2/20 0.38
TDP1 Q9NUW8 2/20 0.38

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
SCHEMBL2037350 1.00 NOD1 (0.43) NOD1GPR84FFAR1PPARDMAPT
SCHEMBL29588653 0.92 NOD1 (0.48) NOD1GPR84FFAR1PPARDMAPT
SCHEMBL30304076 0.92 NOD1 (0.48) NOD1GPR84FFAR1PPARDMAPT
SCHEMBL28485859 0.92 CA2 (0.41) NOD1GPR84FFAR1PPARDMAPT
SCHEMBL20813966 0.87 NOD1 (0.42) NOD1GPR84FFAR1PPARDMAPT
SCHEMBL31321524 0.86 GPR84 (0.44) NOD1GPR84FFAR1PPARDPPARG
SCHEMBL19852728 0.86 GPR84 (0.44) NOD1GPR84FFAR1PPARDPPARG
SCHEMBL19852729 0.86 NOD1 (0.41) NOD1GPR84FFAR1PPARDMAPT
SCHEMBL20813983 0.84 PLA2G2A (0.41) NOD1GPR84FFAR1PPARDMAPT
SCHEMBL12156898 0.84 FDPS (0.39) GRIK1GRIK2CA2MAPK1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9220799-B2 Bactericidal agent composition SUNSTAR ENGINEERING INC. (JP) 2015-12-29 US claimed
WO-2024143126-A1 ORAL COMPOSITION サンスター株式会社 2024-07-04 WO disclosed
US-20240058251-A1 Composition for Oral Cavity SUNSTAR SUISSE SA (CH) 2024-02-22 US disclosed
EP-4268828-A1 COMPOSITION FOR ORAL CAVITY Sunstar Suisse SA (CH) 2023-11-01 EP disclosed
CN-116669693-A Oral composition 盛势达(瑞士)有限公司 2023-08-29 CN disclosed
WO-2022145325-A1 COMPOSITION FOR ORAL CAVITY サンスター スイス エスエー 2022-07-07 WO disclosed
EP-3223791-B1 ORAL CARE COMPOSITIONS HAVING HIGH WATER CONTENT AND MICRO ROBUSTNESS COLGATE PALMOLIVE CO (US) 2022-03-09 EP disclosed
CN-106999405-B Oral care compositions with high water content and little robustness 高露洁-棕榄公司 2020-07-10 CN disclosed
US-10206860-B2 Biguanide preservation of precipitated calcium carbonate COLGATE-PALMOLIVE COMPANY (US) 2019-02-19 US disclosed
US-20170333330-A1 Oral Care Compositions Having High Water Content and Micro Robustness COLGATE-PALMOLIVE COMPANY (US) 2017-11-23 US disclosed
US-20120276023-A1 BIGUANIDE PRESERVATION OF PRECIPITATED CALCIUM CARBONATE COLGATE-PALMOLIVE COMPANY (US) 2012-11-01 US disclosed
EP-2512407-A2 POLYMERIC BIGUANIDE PRESERVATION OF PRECIPITATED CALCIUM CARBONATE Colgate-Palmolive Company (US) 2012-10-24 EP disclosed
WO-2011075662-A2 BIGUANIDE PRESERVATION OF PRECIPITATED CALCIUM CARBONATE COLGATE-PALMOLIVE COMPANY (US) 2011-06-23 WO disclosed
US-20100034871-A1 Center-Filled Chewing Gum Product For Dental Care GUMLINK A/S (DK) 2010-02-11 US disclosed
EP-2136648-A1 CENTER-FILLED CHEWING GUM PRODUCT FOR DENTAL CARE Gumlink A/S (DK) 2009-12-30 EP disclosed
WO-2008122286-A1 CENTER-FILLED CHEWING GUM PRODUCT FOR DENTAL CARE GUMLINK A/S (DK) 2008-10-16 WO disclosed
US-20070187429-A1 Dual opening tubular dispenser FARAHMAND BARDIA 2007-08-16 US disclosed
WO-2000069401-A1 METHOD FOR THE MANUFACTURE OF TOOTHPASTE COLGATE-PALMOLIVE COMPANY (US) 2000-11-23 WO disclosed
US-6149894-A MIXING TOGETHER A HIGH SOLIDS CALCIUM CARBONATE ABRASIVE DISPERSION AND AN AQUEOUS HUMECTANT PRIOR TO ADDING A THICKENER COLGATE PALMOLIVE COMPANY (US) 2000-11-21 US disclosed
US-5882631-A Oral composition SUNSTAR INC. (JP) 1999-03-16 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-10206860-B2 Biguanide preservation of precipitated calcium carbonate CACNA1C, CA2, KCNN3 NOD1 4003/4885GPR84 3022/4885FFAR1 2257/4885
US-20120276023-A1 BIGUANIDE PRESERVATION OF PRECIPITATED CALCIUM CARBONATE CACNA1C, CA2, KCNN3 NOD1 4003/4885GPR84 3022/4885FFAR1 2257/4885

“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.