SCHEMBL1786291

SCHEMBL1786291

C1CSC(N2CCSCC2)CN1

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
SCHEMBL9558182 0.85 HTR6 (0.36)
SCHEMBL8517355 0.83 HTR6 (0.39)
SCHEMBL5459528 0.80 DPP4 (0.31)
SCHEMBL9558179 0.80
SCHEMBL3629325 0.68 HTR6 (0.50)
SCHEMBL3629329 0.68 HTR6 (0.50)
SCHEMBL31208704 0.68 HTR6 (0.50)
SCHEMBL3720100 0.66 HTR6 (0.37)
SCHEMBL22527652 0.65 HTR6 (0.57)
SCHEMBL7473139 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120115845-A1 THERAPEUTIC AGENTS ALLEN JACK MCQUEEN (GB) 2012-05-10 US disclosed
US-20110124621-A1 BENZOTHIAZOLES AS GHRELIN RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2011-05-26 US disclosed
US-20100048543-A1 PYRIMIDINE COMPOUNDS HAVING TIES (TEK) INHIBITORY ACTIVITY ASTRAZENECA AB (SE) 2010-02-25 US disclosed
US-20090186870-A1 Therapeutic Agents - 802 ASTRAZENECA AB (SE) 2009-07-23 US disclosed
US-20090054632-A1 Hydrophobically-modified protein compositions and methods BIOGEN IDEC MA INC. (US) 2009-02-26 US disclosed
US-20080108608-A1 Pyrimidines With Tie2 (Tek) Activity ASTRAZENECA AB (SE) 2008-05-08 US disclosed
EP-1577321-A1 Hydrophobically-modified protein compositions and methods BIOGEN, INC. (US) 2005-09-21 EP disclosed
US-6897297-B1 Hydrophobically-modified protein compositions and methods CURIS, INC. (US) 2005-05-24 US disclosed
EP-1036092-B1 Hydrophobically-modified hedgehog protein compositions and methods BIOGEN INC (US) 2005-05-11 EP disclosed
US-20040067980-A1 Inhibitors of the GPIb-vWF interaction, their preparation and use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2004-04-08 US disclosed
US-6444793-B1 GENETIC ENGINEERING; ACTIVE MATERIALS CURIS, INC. 2002-09-03 US disclosed
WO-1999028876-A2 HYDROPHOBICALLY-MODIFIED PROTEIN COMPOSITIONS AND METHODS BIOGEN, INC. (US) 1999-06-10 WO disclosed