SCHEMBL4031891

SCHEMBL4031891

CC(=O)[N]C=O

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
SCHEMBL11111331 0.73
SCHEMBL3633565 0.69
SCHEMBL12389002 0.67
Acetone SCHEMBL21835119 0.61
Acetone SCHEMBL29657100 0.61
SCHEMBL9936522 0.59 LMNA (0.36)
Acetone SCHEMBL1664573 0.59
SCHEMBL15257797 0.59
SCHEMBL902574 0.59
Methylglyoxal SCHEMBL47032 0.59

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1307454-B1 DERIVATIVES OF VARIOLIN B PHARMA MAR SA (ES) 2009-06-03 EP disclosed
EP-1299388-B1 VARIOLIN DERIVATIVES AS ANTI-CANCER AGENTS PHARMA MAR SA (ES) 2009-05-13 EP disclosed
US-7329666-B2 Derivatives of variolin B PHARMA MAR, S.A. (ES) 2008-02-12 US disclosed
US-20080033001-A1 Derivatives of Variolin B UNIVERSIDAD DE BARCELONA (ES) 2008-02-07 US disclosed
US-7320981-B2 Antitumor agents PHARMA MAR, S.A. (ES) 2008-01-22 US disclosed
US-20050014778-A1 Variolin derivatives as anti-cancer agents PHARMA MAR, S.A. (ES) 2005-01-20 US disclosed
US-20040058939-A1 Derivatives of variolin b PHARMA MAR, S.A. (ES) 2004-03-25 US disclosed
EP-1307454-A1 DERIVATIVES OF VARIOLIN B Universidad de Barcelona (ES) 2003-05-07 EP disclosed
EP-1299388-A1 VARIOLIN DERIVATIVES AS ANTI-CANCER AGENTS PHARMA MAR, S.A. (ES) 2003-04-09 EP disclosed
WO-2002012240-A1 DERIVATIVES OF VARIOLIN B UNIVERSIDAD DE BARCELONA (ES) 2002-02-14 WO disclosed
WO-2002004447-A1 VARIOLIN DERIVATIVES AS ANTI-CANCER AGENTS PHARMA MAR, S.A. (ES) 2002-01-17 WO disclosed
US-5696262-A TRIAZINE DYES FOR POLYAMIDE FIBER; PHOTOSTABILITY, HEAT AND RADIATION RESISTANCE CIBA SPECIALTY CHEMICALS CORPORATION (US) 1997-12-09 US disclosed
US-5578667-A PHOTOSTABILITY, HEAT RESISTANCE CIBA-GEIGY CORPORATION (US) 1996-11-26 US disclosed
EP-0703227-A1 Watersoluble antioxidants, process of their preparation, and their use for the photochemical and thermical stabilisation of polyamide fibers CIBA-GEIGY AG (CH) 1996-03-27 EP disclosed
EP-0702011-A1 Water soluble piperidine-triazine compounds for use as stabilizers for polyamide fibers CIBA-GEIGY AG (CH) 1996-03-20 EP disclosed
US-5312917-A Polyamide fiber stabilizers CIBA-GEIGY CORPORATION (US) 1994-05-17 US disclosed
EP-0546993-A1 Water soluble triazine derivatives for the photochemical and thermal stabilisation of polyamide fiber materials CIBA-GEIGY AG (CH) 1993-06-16 EP disclosed