SCHEMBL2852458

SCHEMBL2852458

NCC1(S(N)(=O)=O)C=CC=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
SCHEMBL7526294 0.75
SCHEMBL27834410 0.67
SCHEMBL1885196 0.67
SCHEMBL18283288 0.65
SCHEMBL28180883 0.63
SCHEMBL27570510 0.63
SCHEMBL5728821 0.61
SCHEMBL6470598 0.61
SCHEMBL18286139 0.60
SCHEMBL7014854 0.60

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7662866-B2 Polymeric support having novel pore structures GE HEALTHCARE BIO-SCIENCES AB (SE) 2010-02-16 US disclosed
EP-1516001-B1 POLYMERIC SUPPORT HAVING PORE STRUCTURES GE HEALTHCARE BIO SCIENCES AB (SE) 2009-03-11 EP disclosed
US-20050245624-A1 Polymeric support having novel pore structures GE HEALTHCARE BIO-SCIENCES AB (SE) 2005-11-03 US disclosed
EP-1516001-A1 POLYMERIC SUPPORT HAVING NOVEL PORE STRUCTURES Amersham Biosciences AB (SE) 2005-03-23 EP disclosed
WO-2004003043-A1 POLYMERIC SUPPORT HAVING NOVEL PORE STRUCTURES AMERSHAM BIOSCIENCES AB (SE) 2004-01-08 WO disclosed