SCHEMBL7526930

SCHEMBL7526930

O=C=NCCCC(SCN=C=O)SCN=C=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
SCHEMBL812404 0.73
SCHEMBL7032167 0.72
SCHEMBL7525997 0.69
SCHEMBL7522880 0.69
SCHEMBL28569297 0.69
SCHEMBL5692863 0.69
SCHEMBL3843217 0.69
SCHEMBL11660910 0.69 LMNA (0.36)
SCHEMBL20391 0.68 MIF (0.33)
SCHEMBL43502 0.68

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-20100247867-A1 RELIEF PRINTING PLATE PRECURSOR FOR LASER ENGRAVING, RESIN COMPOSITION FOR LASER ENGRAVING, RELIEF PRINTING PLATE, AND METHOD FOR MANUFACTURING RELIEF PRINTING PLATE FUJIFILM CORPORATION (JP) 2010-09-30 US disclosed
EP-0713105-B1 Composition for optical materials and use thereof MITSUI CHEMICALS INC (JP) 2002-03-13 EP disclosed
US-5756766-A Composition for optical materials and use thereof MITSUI TOATSU CHEMICALS, INC. (JP) 1998-05-26 US disclosed
US-5652321-A Composition for optical materials and use thereof MITSUI TOATSU CHEMICALS, INC. (JP) 1997-07-29 US disclosed
EP-0713105-A2 Composition for optical materials and use thereof MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1996-05-22 EP disclosed