SCHEMBL7026017

SCHEMBL7026017

Nc1nc2c(ncn2[C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1CCS(=O)(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PNP P00491 1/20 0.51
LMNA P02545 1/20 0.51
TP53 P04637 1/20 0.51
HTT P42858 1/20 0.51
PDE4D Q08499 1/20 0.51
PDE3A Q14432 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
RXFP1 Q9HBX9 1/20 0.51
ADRB1 P08588 1/20 0.48
DNMT1 P26358 1/20 0.48
ADORA3 P0DMS8 1/20 0.47
ADORA1 P30542 1/20 0.47
CYP1A2 P05177 2/20 0.45
TYMP P19971 1/20 0.44
POLA1 P09884 1/20 0.43
HBB P68871 1/20 0.43
HIF1A Q16665 1/20 0.43

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
SCHEMBL2779792 0.84 PNP (0.58) PNPLMNATP53HTTPDE4D
SCHEMBL20567028 0.83 PNP (0.56) PNPLMNATP53HTTPDE4D
SCHEMBL3744956 0.81 PNP (0.60) PNPLMNATP53HTTPDE4D
SCHEMBL6535098 0.81 PNP (0.56) PNPLMNATP53HTTPDE4D
SCHEMBL3425761 0.81 PNP (0.57) PNPLMNATP53HTTPDE4D
SCHEMBL6561796 0.80 PNP (0.53) PNPLMNATP53HTTPDE4D
SCHEMBL23647921 0.79 PNP (0.62) PNPLMNATP53HTTPDE4D
SCHEMBL17521212 0.79 PNP (0.62) PNPLMNATP53HTTPDE4D
SCHEMBL3707304 0.79 PNP (0.62) PNPLMNATP53HTTPDE4D
SCHEMBL7199411 0.79 PNP (0.62) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0818460-B1 Synthesis of Oligonucleotides on a solid support. AVENTIS PHARMA GMBH (DE) 2003-01-15 EP disclosed
EP-0818460-A2 Synthesis of Oligonucleotides on a solid support. HOECHST AKTIENGESELLSCHAFT (DE) 1998-01-14 EP disclosed