SCHEMBL2321956

SCHEMBL2321956

CCOC(=O)C(C)(Br)Br

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
SCHEMBL36821 0.84
SCHEMBL653853 0.84 ALDH1A1 (0.46)
SCHEMBL29958613 0.82 CYP4F2 (0.44)
Methane SCHEMBL21632462 0.82 CYP4F2 (0.44)
SCHEMBL27633249 0.82
SCHEMBL3344606 0.81 ALDH1A1 (0.52)
SCHEMBL9516554 0.81 POLB (0.37)
SCHEMBL297524 0.81
SCHEMBL2812400 0.80 ALDH1A1 (0.46)
SCHEMBL1359837 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8946476-B2 Process for the preparation of amino acid derivatives UCB PHARMA GMBH (DE) 2015-02-03 US disclosed
EP-2352721-B1 NOVEL PROCESS FOR THE PREPARATION OF AMINO ACID DERIVATIVES UCB PHARMA GMBH (DE) 2013-03-27 EP disclosed
US-20110263899-A1 Novel Process for the Preparation of Amino Acid Derivatives UCB PHARMA GMBH (DE) 2011-10-27 US disclosed
EP-2352721-A1 NOVEL PROCESS FOR THE PREPARATION OF AMINO ACID DERIVATIVES UCB Pharma GmbH (DE) 2011-08-10 EP disclosed
WO-2010052011-A1 NOVEL PROCESS FOR THE PREPARATION OF AMINO ACID DERIVATIVES UCB PHARMA, S.A. (BE) 2010-05-14 WO disclosed
EP-1268449-A4 SUBSTITUTED PIPERIDINES AS MELANOCORTIN RECEPTOR AGONISTS MERCK & CO INC (US) 2004-09-15 EP disclosed
EP-1268449-A1 SUBSTITUTED PIPERIDINES AS MELANOCORTIN RECEPTOR AGONISTS Merck & Co., Inc. (US) 2003-01-02 EP disclosed
US-6458790-B2 DIETETICS; ANTIDABETIC AGENTS; SEXUAL DISRDERS MERCK & CO., INC. 2002-10-01 US disclosed
US-20020019523-A1 Substituted piperidines as melanocortin receptor agonists MERCK SHARP & DOHME CORP. 2002-02-14 US disclosed
WO-2001070708-A1 SUBSTITUTED PIPERIDINES AS MELANOCORTIN RECEPTOR AGONISTS MERCK & CO., INC. (US) 2001-09-27 WO disclosed
EP-0923563-A1 1,4-HETEROCYCLIC METALLPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 1999-06-23 EP disclosed
WO-1998008825-A1 1,4-HETEROCYCLIC METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 1998-03-05 WO disclosed
EP-0458325-A1 Negative photosensitive composition and method for forming a resist pattern Mitsubishi Chemical Corporation (JP) 1991-11-27 EP disclosed
US-4188390-A Antihypertensive 4-amino-2-[4-(1,4-benzodioxan-2-carbonyl) piperazin-1-yl or homopiperazin-1-yl]quinazolines PFIZER INC. (US) 1980-02-12 US disclosed