SCHEMBL11910261

SCHEMBL11910261

[C-]#[N+]/C(C#N)=c1\cc/c(=C(/C#N)[N+]#[C-])c2c1C1CCC2C(C2CO2)=C1C1CO1

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
SCHEMBL11910675 0.80 — —
SCHEMBL11910100 0.75 — —
SCHEMBL11910101 0.72 HKDC1 (0.32) —
SCHEMBL12732816 0.63 — —
SCHEMBL11910105 0.62 KDM4E (0.34) —
SCHEMBL10160589 0.59 — —
SCHEMBL11910093 0.58 — —
SCHEMBL10160599 0.56 — —
SCHEMBL11910096 0.56 — —
SCHEMBL11910095 0.56 MEN1 (0.31) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150076469-A1 ORGANIC ELECTROLUMINESCENT ELEMENT Konica Minolta, Inc. (JP) 2015-03-19 — — US disclosed
US-20120193619-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND LIGHTING DEVICE USING SAME KONICA MINOLTA HOLDINGS, INC. (JP) 2012-08-02 — — US disclosed
Send feedback