SCHEMBL3207846

SCHEMBL3207846

O=CN(CCCl)CCCl

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
Hydrochloric Acid SCHEMBL11018061 0.97 LMNA (0.42)
SCHEMBL17333451 0.88
SCHEMBL17333320 0.83
SCHEMBL17333560 0.83
SCHEMBL9505293 0.81 CYP3A4 (0.40)
SCHEMBL11373054 0.79
SCHEMBL12464103 0.76
SCHEMBL17333387 0.74 MEN1 (0.47)
SCHEMBL513584 0.72
SCHEMBL9426596 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0614909-B1 Method for selective acylation of estradiol PERMACHEM ASIA LTD (JP) 1998-06-10 EP claimed
EP-0614909-A2 Method for selective acylation of estradiol PERMACHEM ASIA, LTD. (JP) 1994-09-14 EP claimed
EP-0138153-B1 A SELECTIVE ACYLATION PROCESS AB LEO (SE) 1988-11-23 EP claimed
JP-6263794-A None JP disclosed
US-20170152347-A1 AMIDE DENDRIMER COMPOSITIONS GENZYME CORP (US) 2017-06-01 US disclosed
US-20150321996-A1 AMIDE DENDRIMER COMPOSITIONS GENZYME CORPORATION 2015-11-12 US disclosed
US-9066972-B2 Amide dendrimer compositions GENZYME CORPORATION (US) 2015-06-30 US disclosed
US-8900560-B2 Amide dendrimer compositions GENZYME CORPORATION (US) 2014-12-02 US disclosed
US-20140235724-A1 AMIDE DENDRIMER COMPOSITIONS GENZYME CORPORATION (US) 2014-08-21 US disclosed
US-20130251667-A1 AMIDE DENDRIMER COMPOSITIONS SANOFI (FR) 2013-09-26 US disclosed
US-8425887-B2 Amide dendrimer compositions GENZYME CORPORATION (US) 2013-04-23 US disclosed
WO-2008042222-A2 AMIDE DENDRIMER COMPOSITIONS GENZYME CORPORATION (US) 2008-04-10 WO disclosed
US-6762226-B2 PHOTOSTABILITY; HEAT AND OXIDATION RESISTANCE CIBA SPECIALTY CHEMICALS CORPORATION 2004-07-13 US disclosed
US-20030139500-A1 Compositions stabilized by dioxopiperazinyl derivatives ZEDDA ALESSANDRO (IT) 2003-07-24 US disclosed
US-20020086921-A1 Compositions stabilized by dioxopiperazinyl derivatives ZEDDA ALESSANDRO (IT) 2002-07-04 US disclosed
US-5929297-A FORMING A MIXTURE OF DIMERS, TRIMERS AND OLIGOMERS BY CONTACTING AN ALPHA-OLEFIN WITH A CATALYST SYSTEM OF BORON TRIFLUORIDE, A PROTIC PROMOTER, AND A NITROGEN COMPOUND BEING AN AMIDE, UREA, IMIDE OR CARBAMATE BP AMOCO CORPORATION (US) 1999-07-27 US disclosed
EP-0614909-B1 Method for selective acylation of estradiol PERMACHEM ASIA LTD (JP) 1998-06-10 EP disclosed
JP-H06263794-A METHOD FOR SELECTIVE ACYLATION OF EXTRADIOL PERMACHEM ASIA LTD 1994-09-20 JP disclosed
EP-0614909-A2 Method for selective acylation of estradiol PERMACHEM ASIA, LTD. (JP) 1994-09-14 EP disclosed
EP-0614909-A2 Method for selective acylation of estradiol PERMACHEM ASIA, LTD. (JP) 1994-09-14 EP disclosed