SCHEMBL18503544

SCHEMBL18503544

CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)C1OC

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.74
KMT2A Q03164 1/20 0.74
ADORA3 P0DMS8 2/20 0.66
ADORA1 P30542 1/20 0.60

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
SCHEMBL29421079 1.00 MEN1 (0.74) MEN1KMT2AADORA3ADORA1
SCHEMBL20449961 1.00 MEN1 (0.74) MEN1KMT2AADORA3ADORA1
SCHEMBL665209 1.00 MEN1 (0.74) MEN1KMT2AADORA3ADORA1
SCHEMBL25098313 1.00 MEN1 (0.74) MEN1KMT2AADORA3ADORA1
SCHEMBL7197194 1.00 MEN1 (0.74) MEN1KMT2AADORA3ADORA1
SCHEMBL25097801 1.00 MEN1 (0.74) MEN1KMT2AADORA3ADORA1
SCHEMBL26501998 0.92 MEN1 (0.63) MEN1KMT2AADORA3ADORA1
SCHEMBL9413275 0.91 MEN1 (0.62) MEN1KMT2AADORA3ADORA1
SCHEMBL7922093 0.91 MEN1 (0.73) MEN1KMT2AADORA3ADORA1
SCHEMBL9413276 0.90 MEN1 (0.72) MEN1KMT2AADORA3ADORA1

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
US-20170044619-A1 PROFILING CHEMICALLY MODIFIED DNA/RNA UNITS FOR DISEASE AND CANCER DIAGNOSIS THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK 2017-02-16 US disclosed