SCHEMBL2776064

SCHEMBL2776064

Nc1nc2c(N)nc(N3CCOCC3)nc2[nH]1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.53
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
GLA P06280 1/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
PIK3CA P42336 8/20 0.41
PIK3R1 P27986 6/20 0.41
MTOR P42345 6/20 0.41
HTT P42858 2/20 0.41
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PKM P14618 1/20 0.40
XDH P47989 1/20 0.38
PIK3CD O00329 1/20 0.38
PIK3CB P42338 1/20 0.38
PTPN11 Q06124 1/20 0.37

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
SCHEMBL17822225 0.79 GAA (0.39) GAAKDM4EALDH1A1GLAHPGD
SCHEMBL30677407 0.76 GAA (0.47) GAAKDM4EALDH1A1GLAHPGD
SCHEMBL8607492 0.74 KDM4E (0.57) GAAKDM4EALDH1A1GLAHPGD
SCHEMBL3957743 0.73 CYP1A2 (0.39) GAAALDH1A1HPGDKMT2AMEN1
SCHEMBL13833291 0.72 GAA (0.57) GAAKDM4EALDH1A1GLAHPGD
SCHEMBL19414284 0.70 HTR2A (0.58) GAAKDM4EALDH1A1GLAHPGD
SCHEMBL1994355 0.69 GAA (1.00) GAAKDM4EALDH1A1PIK3CAPIK3R1
SCHEMBL8264499 0.69 ALDH1A1 (0.47) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL8973821 0.69 HTT (0.63) GAAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL1443593 0.68 PIK3CA (0.61) GAAKDM4EALDH1A1GLAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7790877-B2 Antisense oligonucleotides with increased RNase sensitivity GEN-PROBE, INCORPORATED (US) 2010-09-07 US disclosed
EP-1019539-A4 COMBINATORIAL ANTISENSE LIBRARY GEN PROBE INC (US) 2005-03-09 EP disclosed
EP-1019539-A1 COMBINATORIAL ANTISENSE LIBRARY Oasis Biosciences, Inc. (US) 2000-07-19 EP disclosed
WO-1999018238-A1 COMBINATORIAL ANTISENSE LIBRARY OASIS BIOSCIENCES, INC. (US) 1999-04-15 WO disclosed