SCHEMBL5822932

SCHEMBL5822932

O=c1nc(Nc2cccs2)cc[nH]1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.35
NPC1 O15118 6/20 0.35
GAA P10253 8/20 0.33
MEN1 O00255 7/20 0.33
KMT2A Q03164 7/20 0.33
MAPT P10636 6/20 0.33
HSD17B10 Q99714 6/20 0.33
HTT P42858 4/20 0.33
ALDH1A1 P00352 4/20 0.33
HPGD P15428 2/20 0.33
PKM P14618 2/20 0.33
KDM4E B2RXH2 1/20 0.33
RAB9A P51151 8/20 0.33
ALOX15 P16050 5/20 0.33
SMN1; SMN2 Q16637 4/20 0.33
BCAT2 O15382 1/20 0.33
POLB P06746 1/20 0.33
F2 P00734 1/20 0.32
LMNA P02545 2/20 0.31
PARP1 P09874 1/20 0.31

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
SCHEMBL15743154 0.75 MKNK2 (0.32)
SCHEMBL5820392 0.72 RAB9A (0.43) MAPK1NPC1MEN1KMT2AMAPT
SCHEMBL2113287 0.72 MAPT (0.55) MAPK1NPC1GAAMEN1KMT2A
SCHEMBL4245392 0.69 KDM4E (0.55) MAPK1NPC1GAAMEN1KMT2A
SCHEMBL717594 0.69 GAA (0.42) MAPK1NPC1GAAMEN1KMT2A
SCHEMBL5057841 0.68 SCN9A (0.41) NPC1MEN1KMT2AMAPTALDH1A1
SCHEMBL26779179 0.67 GAA (0.46) GAAMEN1KMT2AMAPTHTT
SCHEMBL8944768 0.66
SCHEMBL7876670 0.66
N4-Hydroxycytosine SCHEMBL48396 0.66

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
JP-3739785-B2 2006-01-25 JP claimed
EP-0637965-B1 ENHANCED TRIPLE-HELIX AND DOUBLE-HELIX FORMATION WITH OLIGOMERS CONTAINING MODIFIED PYRIMIDINES ISIS PHARMACEUTICALS INC (US) 2002-10-16 EP claimed
EP-0637965-A4 ENHANCED TRIPLE-HELIX AND DOUBLE-HELIX FORMATION WITH OLIGOMERS CONTAINING MODIFIED PYRIMIDINES. GILEAD SCIENCES INC (US) 1996-01-24 EP claimed
EP-0637965-A1 ENHANCED TRIPLE-HELIX AND DOUBLE-HELIX FORMATION WITH OLIGOMERS CONTAINING MODIFIED PYRIMIDINES GILEAD SCIENCES, INC. (US) 1995-02-15 EP claimed
WO-1993010820-A1 ENHANCED TRIPLE-HELIX AND DOUBLE-HELIX FORMATION WITH OLIGOMERS CONTAINING MODIFIED PYRIMIDINES GILEAD SCIENCES, INC. (US) 1993-06-10 WO claimed