SCHEMBL16631421

SCHEMBL16631421

Cc1cc(=O)c2cn([C@@H]3O[C@H](C)C(O)[C@@H]3O)c(=O)nc2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
TSHR P16473 1/20 0.44
MAPT P10636 1/20 0.44
PMP22 Q01453 1/20 0.44
HBB P68871 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
ADK P55263 11/20 0.37
ADORA3 P0DMS8 2/20 0.34

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
SCHEMBL16631358 0.85 LMNA (0.48) LMNAMAPTPMP22HBBSMN1; SMN2
SCHEMBL16631504 0.84 LMNA (0.44) LMNATSHRMAPTPMP22HBB
SCHEMBL16631656 0.79 LMNA (0.53) LMNATSHRMAPTPMP22HBB
SCHEMBL16631886 0.78 LMNA (0.49) LMNATSHRMAPTPMP22HBB
SCHEMBL16631355 0.76 LMNA (0.52) LMNATSHRMAPTPMP22HBB
SCHEMBL18080281 0.75 P2RY2 (0.59)
SCHEMBL16631376 0.75 LMNA (0.51) LMNATSHRMAPTPMP22HBB
SCHEMBL16631486 0.75 PYGM (0.43) LMNAMAPTPMP22HBB
SCHEMBL16631877 0.74 LMNA (0.46) LMNATSHRMAPTPMP22HBB
SCHEMBL16631667 0.74 LMNA (0.49) LMNATSHRMAPTPMP22HBB

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-2015051173-A2 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC (US) 2015-04-09 WO disclosed