SCHEMBL1781034

SCHEMBL1781034

CN(C)C(=O)CCC#N

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
SCHEMBL11684365 0.78 ALDH1A1 (0.35)
SCHEMBL6826759 0.77
SCHEMBL232706 0.75
SCHEMBL966364 0.75
SCHEMBL1191256 0.74 ALDH1A1 (0.63)
SCHEMBL333490 0.74
SCHEMBL11997953 0.73 ALDH1A1 (0.44)
SCHEMBL968715 0.71 ALDH1A1 (0.43)
SCHEMBL8331213 0.71 ALDH1A1 (0.36)
SCHEMBL304991 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2260020-B1 HYDROXAMATE-BASED INHIBITORS OF DEACETYLASES B NOVARTIS AG (CH) 2014-07-23 EP disclosed
EP-2628726-A1 Hydroxamate-based inhibitors of deacetylases b Novartis AG (CH) 2013-08-21 EP disclosed
US-8349883-B2 Hydroxamate-based inhibitors of deacetylases B NOVARTIS AG (CH) 2013-01-08 US disclosed
US-20110183964-A1 HYDROXAMATE-BASED INHIBITORS OF DEACETYLASES B NOVARTIS AG (CH) 2011-07-28 US disclosed
US-7943652-B2 Hydroxamate-based inhibitors of deacetylases B NOVARTIS AG (CH) 2011-05-17 US disclosed
EP-2260020-A1 HYDROXAMATE-BASED INHIBITORS OF DEACETYLASES B Novartis AG (CH) 2010-12-15 EP disclosed
US-20090247547-A1 HYDROXAMATE-BASED INHIBITORS OF DEACETYLASES B NOVARTIS AG 2009-10-01 US disclosed
WO-2009118305-A1 HYDROXAMATE-BASED INHIBITORS OF DEACETYLASES B NOVARTIS AG (CH) 2009-10-01 WO disclosed
US-6255314-B1 Cancerous metastasis inhibitors containing uracil derivatives TAIHO CHARMACEUTICAL CO., LTD. (JP) 2001-07-03 US disclosed
US-4528373-A Vinylacetylene-terminated polyimide derivatives PLASTICS ENGINEERING COMPANY (US) 1985-07-09 US disclosed
US-4168367-A BY-PRODUCT INHIBITION, CROSSLINKING PLASTICS ENGINEERING COMPANY (US) 1979-09-18 US disclosed
US-4168360-A CROSSLINKED, INSOLUBLE, INFUSIBLE COATINGS AND MOLDING MATERIALS PLASTICS ENGINEERING COMPANY (US) 1979-09-18 US disclosed
US-4168366-A ESTERIFICATION WITH UNSATURATED ALCOHOL PLASTICS ENGINEERING COMPANY (US) 1979-09-18 US disclosed
US-4166168-A POLYMERIZATION PRODUCTS OF ACETYLENE-TERMINATED POLYIMIDE DERIVATIVES PLASTICS ENGINEERING COMPANY (US) 1979-08-28 US disclosed
US-4131730-A Modified polyamic acid from aminophthalic acid anhydride and dianhydride ALELIO GAETANO F D 1978-12-26 US disclosed
US-4118377-A REACTING WITH A CYCLIC DIENE TO FORM ADDUCT, THERMALLY ELIMINATING DIENE TO YIELD EXTENDED BIS-MALEIMIDE UNIVERSITY OF NOTRE DAME DU LAC (US) 1978-10-03 US disclosed
US-4064113-A POLYAMIC ACID ALELIO GAETANO F D 1977-12-20 US disclosed
US-4026904-A Aromatic epoxy-terminated polyimides UNIVERSITY OF NOTRE DAME (US) 1977-05-31 US disclosed
US-3996196-A Polyimide-metallo-phthalocyanines and their preparation UNIVERSITY OF NOTRE DAME DU LAC (US) 1976-12-07 US disclosed
US-3979416-A REFRIGERATED WATER, PRECIPITATION ALELIO GAETANO F D 1976-09-07 US disclosed