SCHEMBL8459012

SCHEMBL8459012

C1#COCCOCCOCCOCCO1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.50
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL8458932 1.00 TTR (0.50) TTRMEN1KMT2AALDH1A1
SCHEMBL8460279 1.00 TTR (0.50) TTRMEN1KMT2AALDH1A1
SCHEMBL4454206 0.87
SCHEMBL3137720 0.71 TTR (1.00) TTRMEN1KMT2AALDH1A1
SCHEMBL78595 0.71 TTR (1.00) TTRMEN1KMT2AALDH1A1
SCHEMBL1119 0.71 TTR (1.00) TTRMEN1KMT2AALDH1A1
Dioxane SCHEMBL3631647 0.71 TTR (1.00) TTRMEN1KMT2AALDH1A1
SCHEMBL11207601 0.71 TTR (1.00) TTRMEN1KMT2AALDH1A1
SCHEMBL6057268 0.71 TTR (1.00) TTRMEN1KMT2AALDH1A1
SCHEMBL16041435 0.71 TTR (1.00) TTRMEN1KMT2AALDH1A1

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
EP-0779888-B1 PYRIMIDO [5,4-D]PYRIMIDINES, DRUGS CONTAINING THESE COMPOUNDS, THEIR USE, AND PROCESS FOR PREPARING THEM BOEHRINGER INGELHEIM PHARMA (DE) 1999-04-28 EP claimed