SCHEMBL2406910

SCHEMBL2406910

NC1=CC(=O)CC=N1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL2432407 0.74
SCHEMBL2227082 0.72
SCHEMBL400697 0.70
SCHEMBL8323712 0.70
SCHEMBL10667404 0.70
SCHEMBL472918 0.70
SCHEMBL3291481 0.68
SCHEMBL3664471 0.65
SCHEMBL535011 0.65
SCHEMBL1199564 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4782363-B2 2011-09-28 JP claimed
EP-1352005-B1 SUPRAMOLECULAR POLYMER FORMING POLYMER HUNTSMAN INT LLC (US) 2008-10-29 EP claimed
US-7390446-B2 fine cell structure, very good surface appearance, a relatively thin skin; As H-bridge-forming monomeric units, substituted ureido-pyrimidones and ureido-pyrimidines were used HUNTSMAN INTERNATIONAL LLC (US) 2008-06-24 US claimed
EP-1332132-B1 ENAMINE DERIVATIVES AS CELL ADHESION MOLECULES UCB PHARMA SA (BE) 2007-10-10 EP claimed
CN-1331924-C Foamed supramolecular polymers HUNTSMAN INT LLC (US) 2007-08-15 CN claimed
CN-1326900-C Supramolecular polymer-forming polymers HUNTSMAN INT LLC (US) 2007-07-18 CN claimed
US-20070149751-A1 Bulk manufacturing of supramolecular polymer forming polymer LINDSAY CHRISTOPHER I 2007-06-28 US claimed
EP-1511794-B1 FOAMED SUPRAMOLECULAR POLYMERS HUNTSMAN INT LLC (US) 2007-05-02 EP claimed
CN-1656157-A Foamed supramolecular polymers HUNTSMAN INT LLC (US) 2005-08-17 CN claimed
US-20050151291-A1 Foamed supramolecular polymers HUNTSMAN INTERNATIONAL LLC 2005-07-14 US claimed
CN-1479759-A Supramolecular polymer forming polymer 2004-03-03 CN claimed
US-20030229116-A1 ENAMINE DERIVATIVES UCB PHARMA S.A. (BE) 2003-12-11 US claimed
WO-2003099875-A2 FOAMED SUPRAMOLECULAR POLYMERS HUNTSMAN INTERNATIONAL LLC (US) 2003-12-04 WO claimed
EP-1352005-A1 SUPRAMOLECULAR POLYMER FORMING POLYMER HUNTSMAN INTERNATIONAL LLC (US) 2003-10-15 EP claimed
US-6610700-B2 Inhibit binding of integrins to their ligands, use in immune or inflammatory disorders; 3-(4-((2,6-Naphthyridinyl)amino)-phenyl)-2-((2-(1-ethylpropyl)-3-oxo-1 -cyclopentenyl) amino)-propionic acid, for example CELLTECH R & D LIMITED (GB) 2003-08-26 US claimed
EP-1332132-A2 ENAMINE DERIVATIVES AS CELL ADHESION MOLECULES Celltech R&amp;D Limited (GB) 2003-08-06 EP claimed
WO-2002046260-A1 SUPRAMOLECULAR POLYMER FORMING POLYMER HUNTSMAN INTERNATIONAL LLC (US) 2002-06-13 WO claimed
EP-1213309-A1 Supramolecular polymer forming polymer HUNTSMAN INTERNATIONAL LLC (US) 2002-06-12 EP claimed
US-20020037909-A1 Enamine derivatives UCB PHARMA S.A. (BE) 2002-03-28 US claimed
WO-2001079173-A2 ENAMINE DERIVATIVES AS CELL ADHESION MOLECULES CELLTECH R & D LIMITED (GB) 2001-10-25 WO claimed