SCHEMBL23607152

SCHEMBL23607152

CCOC[C@@H]1CN(C(c2ccccc2)(c2ccccc2)c2ccccc2)C[C@H](n2ccc(NC(=O)c3ccccc3)nc2=O)O1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.56
RIN1 Q13671 1/20 0.56
POLB P06746 1/20 0.50
P2RY6 Q15077 5/20 0.44
P2RY14 Q15391 2/20 0.44
NT5E P21589 2/20 0.44
P2RY2 P41231 2/20 0.33
P2RY4 P51582 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
GAA P10253 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ROCK2 O75116 1/20 0.32
P2RY12 Q9H244 1/20 0.32
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL14980414 0.88 ABL1 (0.70) ABL1RIN1POLBP2RY6P2RY14
SCHEMBL15090413 0.88 ABL1 (0.70) ABL1RIN1POLBP2RY6P2RY14
SCHEMBL23565661 0.87 ABL1 (0.61) ABL1RIN1POLBP2RY6P2RY14
SCHEMBL21361135 0.87 ABL1 (0.53) ABL1RIN1POLBP2RY6P2RY14
SCHEMBL15090401 0.86 ABL1 (0.54) ABL1RIN1POLBP2RY6P2RY14
SCHEMBL25263770 0.86 ABL1 (0.54) ABL1RIN1POLBP2RY6P2RY14
SCHEMBL25301651 0.86 ABL1 (0.54) ABL1RIN1POLBP2RY6P2RY14
SCHEMBL17589380 0.86 ABL1 (0.54) ABL1RIN1POLBP2RY6P2RY14
SCHEMBL17715010 0.86 ABL1 (0.54) ABL1RIN1POLBP2RY6P2RY14
SCHEMBL15144425 0.86 ABL1 (0.52) ABL1RIN1POLBP2RY6P2RY14

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-2021132591-A1 ANTISENSE NUCLEIC ACID THAT INDUCES SKIPPING OF EXON 50 日本新薬株式会社 2021-07-01 WO disclosed