SCHEMBL15826858

SCHEMBL15826858

CCN(CCC(C)(C)C)c1ccc(/N=N/c2ncc([N+](=O)[O-])s2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 1/20 0.48
▸ MAPT P10636 9/20 0.41
▸ L3MBTL1 Q9Y468 4/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ TDP1 Q9NUW8 3/20 0.41
▸ MAPK1 P28482 3/20 0.41
▸ NPC1 O15118 3/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ ALPL P05186 1/20 0.41
▸ ALPI P09923 1/20 0.41
▸ ALPG P10696 1/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ NFKB2 Q00653 1/20 0.41
▸ RELA Q04206 1/20 0.41
▸ LMNA P02545 6/20 0.39
▸ KMT2A Q03164 6/20 0.39
▸ MEN1 O00255 5/20 0.39
▸ ALDH1A1 P00352 5/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ THRB P10828 2/20 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
SCHEMBL15827073 0.89 KDR (0.54) KDRMAPTL3MBTL1SMN1; SMN2TDP1
SCHEMBL11616761 0.89 KDR (0.53) KDRMAPTL3MBTL1SMN1; SMN2TDP1
SCHEMBL15827084 0.87 KDR (0.60) KDRMAPTL3MBTL1SMN1; SMN2TDP1
SCHEMBL3381131 0.85 KDR (0.48) KDRMAPTL3MBTL1SMN1; SMN2TDP1
SCHEMBL3381126 0.85 KDR (0.48) KDRMAPTL3MBTL1SMN1; SMN2TDP1
SCHEMBL2769578 0.83 KDR (0.46) KDRMAPTL3MBTL1SMN1; SMN2TDP1
SCHEMBL2769580 0.83 KDR (0.46) KDRMAPTL3MBTL1SMN1; SMN2TDP1
SCHEMBL15826861 0.82 MAPT (0.40) KDRMAPTL3MBTL1SMN1; SMN2TDP1
Bromide SCHEMBL2769938 0.82 KDR (0.46) KDRMAPTL3MBTL1SMN1; SMN2TDP1
Bromide SCHEMBL2769935 0.82 KDR (0.46) KDRMAPTL3MBTL1SMN1; SMN2TDP1

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-8759508-B2 Chromophoric silyl protecting groups and their use in the chemical synthesis of oligonucleotides GE HEALTHCARE DHARMACON, INC. (US) 2014-06-24 — — US disclosed
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