SCHEMBL23904666

SCHEMBL23904666

COc1ccc2nc3cc(Cl)ccc3c(NCCCCCCCN)c2c1

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MBNL1 Q9NR56 1/20 0.76
ADORA2A P29274 1/20 0.72
MEN1 O00255 1/20 0.70
KMT2A Q03164 1/20 0.70
TDP1 Q9NUW8 1/20 0.70
GSR P00390 7/20 0.66
KDM4E B2RXH2 1/20 0.55

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
SCHEMBL23904881 1.00 MBNL1 (0.76) MBNL1ADORA2AMEN1KMT2ATDP1
SCHEMBL23904131 0.99 MBNL1 (0.77) MBNL1ADORA2AMEN1KMT2ATDP1
SCHEMBL23795497 0.95 MBNL1 (0.75) MBNL1ADORA2AMEN1KMT2ATDP1
SCHEMBL6895389 0.94 MBNL1 (0.67) MBNL1ADORA2AMEN1KMT2ATDP1
SCHEMBL20087077 0.94 MBNL1 (0.80) MBNL1ADORA2AMEN1KMT2ATDP1
SCHEMBL20087027 0.94 MBNL1 (0.80) MBNL1ADORA2AMEN1KMT2ATDP1
SCHEMBL20087053 0.94 MBNL1 (0.80) MBNL1ADORA2AMEN1KMT2ATDP1
SCHEMBL7869225 0.93 MBNL1 (0.81) MBNL1ADORA2AMEN1KMT2ATDP1
SCHEMBL8902680 0.93 MBNL1 (0.67) MBNL1ADORA2AMEN1KMT2ATDP1
SCHEMBL27739751 0.93 ADORA2A (0.74) MBNL1ADORA2AMEN1KMT2ATDP1

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
WO-2021202669-A2 NUCLEOSIDE AND NUCLEOTIDE CONJUGATE COMPOUNDS AND USES THEREOF REYOUNG CORPORATION (US) 2021-10-07 WO disclosed