Allylamine

Allylamine

SCHEMBL4579987

C=CCN.O=S(=O)(O)CCO

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
BLM P54132 2/20 0.46
SLC6A6 P31641 1/20 0.46
CYP2C19 P33261 1/20 0.46
ALDH1A1 P00352 3/20 0.43
APP P05067 1/20 0.42
PTGS1 P23219 1/20 0.35
PDE4A P27815 1/20 0.35
POLB P06746 3/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 2/20 0.33
NPC1 O15118 1/20 0.33
ALOX15 P16050 1/20 0.33
BRCA1 P38398 1/20 0.33
HTT P42858 1/20 0.33
GMNN O75496 1/20 0.33
PKM P14618 1/20 0.33
THPO P40225 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
SCHEMBL28703540 0.82 LMNA (0.58) LMNABLMSLC6A6CYP2C19ALDH1A1
SCHEMBL3260880 0.81 LMNA (0.35) LMNABLMSLC6A6CYP2C19ALDH1A1
Ethylenediamine SCHEMBL14741933 0.79 LMNA (0.63) LMNABLMSLC6A6CYP2C19ALDH1A1
Monoethanolamine SCHEMBL9784964 0.79 LMNA (0.63) LMNABLMSLC6A6CYP2C19ALDH1A1
Allylamine SCHEMBL9751261 0.79 LMNA (0.44) LMNABLMSLC6A6CYP2C19ALDH1A1
Sulfuric Acid SCHEMBL270945 0.79
Sulfuric Acid SCHEMBL3951699 0.79 ALDH1A1 (0.60) LMNABLMSLC6A6CYP2C19ALDH1A1
SCHEMBL249947 0.79 LMNA (0.50) LMNABLMSLC6A6CYP2C19ALDH1A1
SCHEMBL827 0.79
SCHEMBL27716931 0.77 CA1 (0.36) LMNABLMSLC6A6CYP2C19ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080300161-A1 Ethylenically unsaturated amine salts of sulfonic, phosphoric and carboxylis acids SCHULTZ ALFRED K 2008-12-04 US disclosed
US-7423167-B2 Ethylenically unsaturated amine salts of sulfonic, phosphoric and carboxylic acids STEPAN COMPANY (US) 2008-09-09 US disclosed
US-7026418-B2 Emulsion polymerization process utilizing ethylenically unsaturated amine salts of sulfonic, phosphoric and carboxylic acids STEPAN COMPANY (US) 2006-04-11 US disclosed
US-20050131080-A1 Ethylenically unsaturated amine salts of sulfonic, phosphoric and carboxylic acids STEPAN COMPANY, A CORPORATION OF THE STATE OF DELAWARE 2005-06-16 US disclosed
US-6900265-B2 Antimicrobial polymer latexes derived from unsaturated quaternary ammonium compounds and antimicrobial coatings, sealants, adhesives and elastomers produced from such latexes STEPAN COMPANY (US) 2005-05-31 US disclosed
US-20050010009-A1 Emulsion polymerization process utilizing ethylenically unsaturated amine salts of sulfonic, phosphoric and carboxylic acids STEPAN COMPANY, A CORPORATION OF THE STATE OF DELAWARE 2005-01-13 US disclosed
US-20040092632-A1 Antimicrobial polymer latexes derived from unsaturated quaternary ammonium compounds and antimicrobial coatings, sealants, adhesives and elastomers produced from such latexes STEPAN COMPANY 2004-05-13 US disclosed
EP-1102794-B1 IMPROVED COATINGS, SEALANTS, ADHESIVES AND ELASTOMERS UTILIZING POLYMER LATEXES DERIVED FROM UNSATURATED AMINE SALTS STEPAN CO (US) 2004-02-25 EP disclosed
EP-0960134-B1 EMULSION POLYMERISATION PROCESS UTILISING ETHYLENICALLY UNSATURATED AMINE SALTS OF SULPHONIC, PHOSPHORIC AND CARBOXYLIC ACIDS STEPAN CO (US) 2004-01-28 EP disclosed
US-20030149119-A1 Ethylenically unsaturated amine salts of sulfonic, phosphoric, and carboxylic acids STEPAN COMPANY 2003-08-07 US disclosed
EP-1102794-A1 IMPROVED COATINGS, SEALANTS, ADHESIVES AND ELASTOMERS UTILIZING POLYMER LATEXES DERIVED FROM UNSATURATED AMINE SALTS STEPAN COMPANY (US) 2001-05-30 EP disclosed
US-6239240-B1 Emulsion polymerization process utilizing ethylenically unsaturated amine salts of sulfonic, phosphoric and carboxylic acids STEPAN COMPANY 2001-05-29 US disclosed
EP-1100325-A1 POLYMER LATEXES PREPARED FROM ETHYLENICALLY UNSATURATED AMINE SALTS STEPAN COMPANY (US) 2001-05-23 EP disclosed
WO-2000006612-A1 ANTIMICROBIAL POLYMER LATEXES DERIVED FROM UNSATURATED QUATERNARY AMMONIUM COMPOUNDS AND ANTIMICROBIAL COATINGS, SEALANTS, ADHESIVES AND ELASTOMERS PRODUCED FROM SUCH LATEXES STEPAN COMPANY (US) 2000-02-10 WO disclosed
WO-2000005950-A1 POLYMER LATEXES PREPARED FROM ETHYLENICALLY UNSATURATED AMINE SALTS STEPAN COMPANY (US) 2000-02-10 WO disclosed
WO-2000006611-A1 IMPROVED COATINGS, SEALANTS, ADHESIVES AND ELASTOMERS UTILIZING POLYMER LATEXES DERIVED FROM UNSATURATED AMINE SALTS STEPAN COMPANY (US) 2000-02-10 WO disclosed
EP-0960134-A1 IMPROVED EMULSION POLYMERIZATION PROCESS UTILIZING ETHYLENICALLY UNSATURATED AMINE SALTS OF SULFONIC, PHOSPHORIC AND CARBOXYLIC ACIDS STEPAN COMPANY (US) 1999-12-01 EP disclosed
EP-0958273-A1 NOVEL ETHYLENICALLY UNSATURATED AMINE SALTS OF SULFONIC, PHOSPHORIC AND CARBOXYLIC ACIDS STEPAN COMPANY (US) 1999-11-24 EP disclosed
WO-1998032726-A1 NOVEL ETHYLENICALLY UNSATURATED AMINE SALTS OF SULFONIC, PHOSPHORIC AND CARBOXYLIC ACIDS STEPAN COMPANY (US) 1998-07-30 WO disclosed
WO-1998032773-A1 IMPROVED EMULSION POLYMERIZATION PROCESS UTILIZING ETHYLENICALLY UNSATURATED AMINE SALTS OF SULFONIC, PHOSPHORIC AND CARBOXYLIC ACIDS STEPAN COMPANY (US) 1998-07-30 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-20080300161-A1 Ethylenically unsaturated amine salts of sulfonic, phosphoric and carboxylis acids PHOSPHO1, PTDSS1, SELENOI LMNA 3256/4885BLM 3296/4885SLC6A6 928/4885

“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.