SCHEMBL28825877

SCHEMBL28825877

CCCCC(OC)C(OC)(OC)OC

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
ALDH1A1 P00352 2/20 0.30
TDP1 Q9NUW8 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL2166252 0.91 ZDHHC7 (0.37) DNM1
SCHEMBL9498255 0.91 ZDHHC7 (0.37) DNM1
SCHEMBL27343922 0.91 ZDHHC7 (0.37) DNM1
SCHEMBL5839501 0.87 CA1 (0.33) CA1CA2
SCHEMBL8964563 0.85
SCHEMBL5839507 0.82 CA1 (0.31) DNM1CA1CA2
SCHEMBL227005 0.80 ZDHHC7 (0.33) DNM1
SCHEMBL230843 0.80 ZDHHC7 (0.33) DNM1
SCHEMBL230811 0.80 ZDHHC7 (0.33) DNM1
SCHEMBL28057052 0.78 CA2 (0.39) DNM1CA1CA2ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105315308-A Organic electroluminescent material and device UNIVERSAL DISPLAY CORP 2016-02-10 CN disclosed