SCHEMBL4617835

SCHEMBL4617835

CCN(CC)CCN1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.49
SLC6A3 Q01959 4/20 0.48
SLC6A4 P31645 2/20 0.48
DRD2 P14416 2/20 0.46
SLC6A2 P23975 1/20 0.46
HRH3 Q9Y5N1 6/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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 SCHEMBL11609607 0.98 SIGMAR1 (0.47) SIGMAR1SLC6A3SLC6A4DRD2SLC6A2
SCHEMBL13701445 0.98 SIGMAR1 (0.50) SIGMAR1SLC6A3SLC6A4DRD2SLC6A2
SCHEMBL11955738 0.93 SIGMAR1 (0.46) SIGMAR1SLC6A3SLC6A4DRD2SLC6A2
SCHEMBL11922753 0.86 HRH3 (0.52) HRH3
SCHEMBL13962700 0.84 SIGMAR1 (0.54) SIGMAR1SLC6A3SLC6A4DRD2SLC6A2
SCHEMBL12156673 0.84 HRH3 (0.48) SIGMAR1HRH3
SCHEMBL21243049 0.83 SIGMAR1 (0.41) SIGMAR1SLC6A3SLC6A4DRD2
SCHEMBL18379164 0.83 SIGMAR1 (0.48) SIGMAR1SLC6A3SLC6A4DRD2SLC6A2
SCHEMBL20333471 0.82 HRH3 (0.52) SIGMAR1SLC6A3SLC6A4HRH3
SCHEMBL10058642 0.82 HRH3 (0.48) SIGMAR1HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103059005-B Chrysin amide derivative and medical application thereof UNIV SOUTH CENTRAL NATIONALITI 2015-04-22 CN disclosed
CN-103059005-A Chrysin amide derivative and medical application thereof UNIV SOUTH CENTRAL NATIONALITI 2013-04-24 CN disclosed
WO-2011161446-A1 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS THE UNIVERSITY OF NOTTINGHAM (GB) 2011-12-29 WO disclosed
US-7482352-B2 Chemical derivatives and their application as antitelomerase agents AVENTIS PHARMA S.A. (FR) 2009-01-27 US disclosed
EP-1893663-B1 METHOD FOR THE PRODUCTION OF POLYAMINES COMPRISING PRIMARY AMINO GROUPS BAYER MATERIALSCIENCE AG (DE) 2008-11-26 EP disclosed
EP-1893663-A1 METHOD FOR THE PRODUCTION OF POLYAMINES COMPRISING PRIMARY AMINO GROUPS Bayer MaterialScience AG (DE) 2008-03-05 EP disclosed
WO-2006133839-A1 METHOD FOR THE PRODUCTION OF POLYAMINES COMPRISING PRIMARY AMINO GROUPS BAYER MATERIALSCIENCE AG (DE) 2006-12-21 WO disclosed
US-20060287462-A1 Process for preparing polyamines having primary amino groups BAYER MATERIALSCIENCE AG (DE) 2006-12-21 US disclosed
US-5283364-A Hydrolysis of isocyanates with water in presence of amide solvent BAYER AKTIENGESELLSCHAFT (DE) 1994-02-01 US disclosed
EP-0255677-B1 Process for producing Polyamino-hydroxy compounds containing urethane and/or urea groups and their use in the production of polyurea urethanes BAYER AG (DE) 1993-12-08 EP disclosed
US-4970342-A ONE STEP HYDROLYSIS OF ISOCYANATE GROUP CONTAINING COMPOUNDS IN PRESENCE OF EXCESS WATER AND TERTIARY AMINE CATALYST BAYER AKTIENGESELLSCHAFT (DE) 1990-11-13 US disclosed
US-4740531-A REACTION INJECTION MOLDING MATERIALS; LOW VISCOSITY; COMPACT SURFACES BAYER AKTIENGESELLSCHAFT (DE) 1988-04-26 US disclosed
EP-0255677-A1 Process for producing Polyamino-hydroxy compounds containing urethane and/or urea groups and their use in the production of polyurea urethanes BAYER AG (DE) 1988-02-10 EP disclosed
EP-0219035-A2 Process for the preparation of polyamines, and their use in the preparation of polyurethanes BAYER AG (DE) 1987-04-22 EP disclosed
EP-0097298-B1 POLYAMINES, PROCESS FOR PRODUCING POLYAMINES AND THEIR USE IN THE PRODUCTION OF POLYURETHANES BAYER AG (DE) 1986-04-30 EP disclosed
EP-0097299-B1 POLYAMINES, PROCESS FOR PRODUCING POLYAMINES AND THEIR USE IN THE PRODUCTION OF POLYURETHANES BAYER AG (DE) 1986-04-16 EP disclosed
US-4501873-A USING BASIC CATALYST BAYER AKTIENGESELLSCHAFT (DE) 1985-02-26 US disclosed
EP-0113020-A1 Reaction components containing amino groups, process for their preparation and their use BAYER AG (DE) 1984-07-11 EP disclosed
EP-0097298-A2 Polyamines, process for producing polyamines and their use in the production of polyurethanes BAYER AG (DE) 1984-01-04 EP disclosed
EP-0097299-A2 Polyamines, process for producing polyamines and their use in the production of polyurethanes BAYER AG (DE) 1984-01-04 EP disclosed