SCHEMBL3861607

SCHEMBL3861607

CC(CN)=C(O)O

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
SCHEMBL20888882 0.79
SCHEMBL37690 0.72
SCHEMBL2835744 0.70
SCHEMBL29042190 0.69
SCHEMBL21548054 0.69
SCHEMBL5180605 0.69
SCHEMBL23764819 0.67
SCHEMBL28696375 0.67
SCHEMBL28378220 0.67
SCHEMBL24072325 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1709186-B1 CHARCOAL STABILIZATION OF PHENYL PHOSPHATES SURMODICS IVD INC (US) 2013-04-24 EP disclosed
EP-1709186-A4 CHARCOAL STABILIZATION OF PHENYL PHOSPHATES BIOFX LAB INC (US) 2009-01-14 EP disclosed
US-7214481-B2 Charcoal stabilization of phenyl phosphates BIOFX LABORATORIES, INC. (US) 2007-05-08 US disclosed
EP-1709186-A1 CHARCOAL STABILIZATION OF PHENYL PHOSPHATES Biofx Laboratories, Inc. (US) 2006-10-11 EP disclosed
US-20060063220-A1 Charcoal stabilization of phenyl phosphates BIOFX LABORATORIES, INC. (US) 2006-03-23 US disclosed
US-7001717-B2 Charcoal stabilization of phenyl phosphates BIOFX LABORATORIES, INC. (US) 2006-02-21 US disclosed
WO-2005056816-A1 CHARCOAL STABILIZATION OF PHENYL PHOSPHATES BIOFX LABORATORIES, INC. (US) 2005-06-23 WO disclosed
US-20050124024-A1 Charcoal stabilization of phenyl phosphates BIOFX LABORATORIES, INC. (US) 2005-06-09 US disclosed