SCHEMBL5507967

SCHEMBL5507967

CC(C)(C)[Si](C)(C)OCCn1cnc2c(N)nc(N)nc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 3/20 0.57
CCNB1 P14635 3/20 0.57
CCNE1 P24864 3/20 0.57
CDK2 P24941 3/20 0.57
HSP90AA1 P07900 1/20 0.44
HSP90AB1 P08238 1/20 0.44
NSD3 Q9BZ95 6/20 0.41
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ADORA2A P29274 2/20 0.40
ADORA1 P30542 2/20 0.40
ADORA2B P29275 1/20 0.40
HPGD P15428 1/20 0.39
PI4KA P42356 1/20 0.39
PI4K2B Q8TCG2 1/20 0.39
PI4K2A Q9BTU6 1/20 0.39
PI4KB Q9UBF8 1/20 0.39
NSD2 O96028 5/20 0.39
TMIGD3 P0DMS9 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL28301970 0.82 CDK1 (0.65) CDK1CCNB1CCNE1CDK2HSP90AA1
SCHEMBL22411550 0.78 P2RX7 (0.41) CDK1HSP90AA1HSP90AB1LMNA
SCHEMBL1377647 0.77 CDK1 (0.76) CDK1CCNB1CCNE1CDK2HSP90AA1
SCHEMBL31178138 0.77 CNR2 (0.35) CDK1CCNB1CCNE1CDK2HSP90AA1
SCHEMBL215612 0.77 CDK1 (0.57) CDK1CCNB1CCNE1CDK2HSP90AA1
SCHEMBL7759473 0.76 CDK1 (0.53) CDK1CCNB1CCNE1CDK2HSP90AA1
SCHEMBL16134183 0.76 CCNE1 (0.69) CDK1CCNB1CCNE1CDK2HSP90AA1
SCHEMBL27871148 0.76 CDK1 (0.56) CDK1CCNB1CCNE1CDK2HSP90AA1
SCHEMBL4022228 0.75 CCNE1 (0.68) CDK1CCNB1CCNE1CDK2HSP90AA1
SCHEMBL24721834 0.75 FGFR1 (0.56) CDK1CCNB1CCNE1CDK2HSP90AA1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0977767-B1 AMINOOXY-MODIFIED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS INC (US) 2007-09-19 EP disclosed
EP-0977767-A4 AMINOOXY-MODIFIED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS INC (US) 2003-04-23 EP disclosed
EP-0977767-A1 AMINOOXY-MODIFIED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 2000-02-09 EP disclosed
WO-1998035978-A9 AMINOOXY-MODIFIED OLIGONUCLEOTIDES 1999-01-14 WO disclosed
WO-1998035978-A1 AMINOOXY-MODIFIED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 1998-08-20 WO disclosed