SCHEMBL23547992

SCHEMBL23547992

CC(C)N(C(C)C)P(OCCC#N)OC[C@H]1O[C@@H](n2cnc3c(NC(=O)c4ccccc4)ncnc32)C[C@@H]1N

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PRMT6 Q96LA8 1/20 0.40
P2RY12 Q9H244 8/20 0.38
P2RY2 P41231 1/20 0.37
P2RY1 P47900 1/20 0.37
P2RY6 Q15077 1/20 0.37
ADORA1 P30542 1/20 0.36
DNPH1 O43598 1/20 0.35

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
SCHEMBL17231772 0.89 P2RY12 (0.37) PRMT6P2RY12P2RY2P2RY1P2RY6
SCHEMBL5482086 0.89 P2RY12 (0.37) PRMT6P2RY12P2RY2P2RY1P2RY6
SCHEMBL25505318 0.88 PRMT6 (0.39) PRMT6P2RY12ADORA1
SCHEMBL19146295 0.88 PRMT6 (0.38) PRMT6P2RY12
SCHEMBL13255809 0.88 PRMT6 (0.38) PRMT6P2RY12P2RY2P2RY1P2RY6
SCHEMBL25504694 0.87 ADORA1 (0.41) PRMT6ADORA1
SCHEMBL23547876 0.87 PRMT6 (0.43) PRMT6P2RY12P2RY2P2RY1P2RY6
SCHEMBL23547931 0.87 PRMT6 (0.37) PRMT6P2RY12ADORA1
SCHEMBL23547756 0.86 PRMT6 (0.45) PRMT6P2RY12P2RY2P2RY1P2RY6
SCHEMBL21376546 0.86 PRMT6 (0.39) PRMT6P2RY12ADORA1

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-20210189392-A1 S-ANTIGEN TRANSPORT INHIBITING OLIGONUCLEOTIDE POLYMERS AND METHODS ALIGOS THERAPEUTICS, INC. 2021-06-24 US disclosed