SCHEMBL3971370

SCHEMBL3971370

CCCC(=S)CBr

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
SCHEMBL4019230 0.79
SCHEMBL7112610 0.73 CES2 (0.37)
SCHEMBL4965257 0.73
SCHEMBL27173489 0.69
SCHEMBL1932050 0.69
SCHEMBL5388382 0.69
SCHEMBL14771979 0.69
SCHEMBL10841225 0.67
SCHEMBL1931623 0.67
SCHEMBL27417148 0.67

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
EP-1112254-B1 CYANINE DYES AND SYNTHESIS METHODS THEREOF NEN LIFE SCIENCE PROD INC (US) 2013-02-27 EP disclosed
US-7524942-B2 Labeled nucleotide composition AGILENT TECHNOLOGIES, INC. (US) 2009-04-28 US disclosed
US-20080124708-A1 Labeled nucleotide composition AGILENT TECHNOLOGIES, INC. 2008-05-29 US disclosed
EP-1112254-A4 CYANINE DYES AND SYNTHESIS METHODS THEREOF NEN LIFE SCIENCE PROD INC (US) 2005-03-16 EP disclosed
US-6437141-B2 FOR LABELING TARGET MOLECULES NEN LIFE SCIENCE PRODUCTS, INC. 2002-08-20 US disclosed
US-20010020098-A1 For labeling target molecules NEN LIFE SCIENCE PRODUCTS, INC. 2001-09-06 US disclosed
EP-1112254-A2 CYANINE DYES AND SYNTHESIS METHODS THEREOF NEN Life Science Products, Inc. (US) 2001-07-04 EP disclosed
US-6224644-B1 CYANINE DYES INCLUDES FREE OR PROTECTED THIOL, AMINE OR HYDROXY SUBSTITUENT CAPABLE OF REACTING WITH A TARGET MOLECULE THROUGH A NEUCLOPHILIC DISPLACEMENT, USEFUL IN LABELING A VARIETY OF TARGET MOLECULES NEN LIFE SCIENCE PRODUCTS, INC. 2001-05-01 US disclosed
US-6204389-B1 DEBLOCKING; NUCLEOPHILIC DISPLACEMENT NEN LIFE SCIENCE PRODUCTS, INC. 2001-03-20 US disclosed
US-6197956-B1 FLUORESCENT BENZIMIDAZOLE, BENZOTHIAZOLE, BENZOXAZOLE, BENZOTHIAZINE, BENZOXAZINE AND QUINOLINE DYES NEN LIFE SCIENCE PRODUCTS, INC. 2001-03-06 US disclosed
WO-2000063296-A2 CYANINE DYES AND SYNTHESIS METHODS THEREOF NEN LIFE SCIENCE PRODUCTS, INC. (US) 2000-10-26 WO disclosed
US-6114350-A Cyanine dyes and synthesis methods thereof NEN LIFE SCIENCE PRODUCTS, INC. (US) 2000-09-05 US disclosed