SCHEMBL4450358

SCHEMBL4450358

CO[C@@H]1[C@H](O)[C@@H](COC(=O)c2ccccc2)O[C@H]1n1ccc(N)nc1=O

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
LMNA P02545 1/20 0.52
THRB P10828 1/20 0.52
MTOR P42345 1/20 0.52
MDM2 Q00987 1/20 0.52
NCOA1 Q15788 1/20 0.52
NCOA3 Q9Y6Q9 1/20 0.52
HTT P42858 1/20 0.52
ST6GAL1 P15907 5/20 0.51
L3MBTL1 Q9Y468 1/20 0.47
TSHR P16473 1/20 0.47
GLA P06280 1/20 0.47
NT5E P21589 1/20 0.45
P2RY6 Q15077 1/20 0.45
P2RY14 Q15391 1/20 0.45
P2RY2 P41231 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
SCHEMBL2031869 0.89 LMNA (0.55) LMNATHRBMTORMDM2NCOA1
SCHEMBL441997 0.89 LMNA (0.66) ALDH1A1LMNATHRBMTORMDM2
SCHEMBL13678671 0.89 LMNA (0.66) ALDH1A1LMNATHRBMTORMDM2
Hydrochloric Acid SCHEMBL11852550 0.88 LMNA (0.65) ALDH1A1LMNATHRBMTORMDM2
SCHEMBL5580071 0.87 LMNA (0.59) LMNATHRBMTORMDM2NCOA1
SCHEMBL6361611 0.86 ALDH1A1 (0.49) ALDH1A1LMNATHRBMTORMDM2
SCHEMBL6301832 0.86 ALDH1A1 (0.50) ALDH1A1LMNATHRBMTORMDM2
SCHEMBL1525218 0.86 ALDH1A1 (0.56) ALDH1A1LMNATHRBMTORMDM2
SCHEMBL28197797 0.85 LMNA (0.55) ALDH1A1LMNATHRBMTORMDM2
SCHEMBL8516844 0.85 MEN1 (0.59) ALDH1A1LMNATHRBMTORMDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090198047-A1 2'-Modified Oligonucleotides ISIS PHARMACEUTICALS, INC. (US) 2009-08-06 US disclosed
US-20080032945-A1 2'-MODIFIED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 2008-02-07 US disclosed
US-7138517-B2 Sugar modified oligonucleotides ISIS PHARMACEUTICALS, INC. (US) 2006-11-21 US disclosed
US-20030187240-A1 2' -modified oligonucleotides ISIS PHARMACEUTICALS, INC. 2003-10-02 US disclosed
US-20030004325-A1 Sugar modified oligonucleotides ISIS PHARMACEUTICALS, INC. 2003-01-02 US disclosed
US-6399754-B1 CONTAINING SULFOPHOSPHATE GROUP ISIS PHARMACEUTICALS, INC. 2002-06-04 US disclosed