SCHEMBL9755548

SCHEMBL9755548

Nc1ccn([C@@H]2O[C@H](CO)[C@@H]3O[C@@H]32)c(=O)n1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.72
MTOR P42345 2/20 0.72
THRB P10828 1/20 0.72
MDM2 Q00987 1/20 0.72
NCOA1 Q15788 1/20 0.72
NCOA3 Q9Y6Q9 1/20 0.72
PDE3A Q14432 3/20 0.57
PDE4D Q08499 1/20 0.57
SLC29A1 Q99808 1/20 0.57
CACNA1F O60840 2/20 0.52
ALB P02768 2/20 0.52
MAPT P10636 2/20 0.52
CACNA1D Q01668 2/20 0.52
CACNA1S Q13698 2/20 0.52
CACNA1C Q13936 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 2/20 0.45
P2RY12 Q9H244 2/20 0.45
POLB P06746 1/20 0.45
GMNN O75496 1/20 0.45

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
SCHEMBL11879932 0.86 LMNA (0.65) LMNAMTORTHRBMDM2NCOA1
SCHEMBL11422515 0.86 LMNA (0.65) LMNAMTORTHRBMDM2NCOA1
SCHEMBL13003005 0.85 LMNA (0.63) LMNAMTORTHRBMDM2NCOA1
SCHEMBL26320640 0.85 LMNA (0.63) LMNAMTORTHRBMDM2NCOA1
SCHEMBL20668731 0.85 LMNA (0.63) LMNAMTORTHRBMDM2NCOA1
SCHEMBL9467302 0.85 LMNA (0.63) LMNAMTORTHRBMDM2NCOA1
Cifostodine SCHEMBL30753567 0.85 LMNA (0.63) LMNAMTORTHRBMDM2NCOA1
Cifostodine SCHEMBL1229741 0.85 LMNA (0.63) LMNAMTORTHRBMDM2NCOA1
SCHEMBL22678626 0.85 LMNA (0.92) LMNAMTORTHRBMDM2NCOA1
SCHEMBL9140489 0.85 LMNA (0.74) LMNAMTORTHRBMDM2NCOA1

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-1991019727-A1 5'-HYDROGENPHOSPHONATES AND 5'-METHYLPHOSPHONATES OF SUGAR MODIFIED NUCLEOSIDES, COMPOSITIONS AND USES THEREOF SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1991-12-26 WO disclosed