SCHEMBL9057933

SCHEMBL9057933

CCC(CC=COC=CCC(CC)N=C=O)N=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
SCHEMBL3700155 0.77
SCHEMBL9579001 0.74
SCHEMBL332238 0.73
SCHEMBL5172943 0.69
SCHEMBL4122966 0.69
SCHEMBL21462814 0.66
SCHEMBL26651090 0.66
SCHEMBL8468374 0.66
SCHEMBL482510 0.66
SCHEMBL16353948 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0425436-B1 Reactive silicone and/or fluorine containing hydrophilic prepolymers and polymers thereof CIBA GEIGY AG (CH) 1996-12-27 EP claimed
EP-0493320-B1 Fluorine and/or Silicone containing poly(alkylene-oxide)-block copolymer hydrogels and contact lenses thereof CIBA GEIGY AG (CH) 1996-07-31 EP claimed
EP-0406161-B1 Fluorine and/or silicone containing poly(alkylene-oxide)-block copolymers and contact lenses thereof CIBA GEIGY AG (CH) 1995-02-22 EP claimed
EP-0176481-B1 UNSATURATED POLYSILOXANES, POLYMERIZABLE COMPOSITIONS AND CONTACT LENSES THEREFROM CIBA-GEIGY AG (CH) 1991-12-11 EP disclosed