SCHEMBL9548872

SCHEMBL9548872

C[SiH](C)OC[C@H]1O[C@@H](n2cnc3c(N)nc(N)nc32)C[C@@H]1OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PNP P00491 1/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
HTT P42858 1/20 0.43
PDE4D Q08499 1/20 0.43
PDE3A Q14432 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
NT5E P21589 2/20 0.42
HINT1 P49773 2/20 0.40
AHCY P23526 1/20 0.39
P2RY1 P47900 1/20 0.39
POLB P06746 1/20 0.37
HSP90B1 P14625 1/20 0.36

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
SCHEMBL23621823 0.85 PNP (0.44) PNPLMNATP53HTTPDE4D
SCHEMBL9548809 0.80 TYMP (0.51) LMNA
SCHEMBL25818680 0.77 POLB (0.49) TP53PDE4DPDE3ASMN1; SMN2AHCY
SCHEMBL9548885 0.76 PNP (0.54) PNPLMNATP53HTTPDE4D
SCHEMBL26782125 0.74 PNP (0.51) PNPLMNATP53HTTPDE4D
SCHEMBL15280844 0.73 POLB (0.47) TP53SMN1; SMN2AHCYP2RY1POLB
SCHEMBL19887008 0.73 POLB (0.47) TP53SMN1; SMN2AHCYP2RY1POLB
SCHEMBL8970868 0.73 LMNA (0.58) PNPLMNATP53HTTPDE4D
SCHEMBL22300667 0.73 LMNA (0.58) PNPLMNATP53HTTPDE4D
SCHEMBL21958777 0.73 P2RY1 (0.40) PNPLMNATP53HTTPDE4D

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-5192749-A Viricide, AIDS SYNTEX (U.S.A.) INC. (US) 1993-03-09 US disclosed