SCHEMBL7653783

SCHEMBL7653783

O=C(OC[C@H]1O[C@@H](n2cc(I)c(=O)[nH]c2=O)CC1OC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RNASE1 P07998 1/20 0.65
TK1 P04183 1/20 0.51
BCHE P06276 2/20 0.47
POLB P06746 2/20 0.47
TYMS P04818 2/20 0.45
MEN1 O00255 1/20 0.44
USP2 O75604 1/20 0.44
KMT2A Q03164 1/20 0.44
UPP1 Q16831 1/20 0.42
PPM1B O75688 1/20 0.40

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
SCHEMBL2632480 1.00 RNASE1 (0.65) RNASE1TK1BCHEPOLBTYMS
SCHEMBL6842685 1.00 RNASE1 (0.65) RNASE1TK1BCHEPOLBTYMS
SCHEMBL2623807 1.00 RNASE1 (0.65) RNASE1TK1BCHEPOLBTYMS
SCHEMBL13273272 1.00 RNASE1 (0.65) RNASE1TK1BCHEPOLBTYMS
SCHEMBL30698170 0.91 RNASE1 (0.61) RNASE1TK1BCHETYMSUPP1
SCHEMBL6542150 0.91 RNASE1 (0.61) RNASE1TK1BCHETYMSUPP1
SCHEMBL22992340 0.89 RNASE1 (0.82) RNASE1TK1
SCHEMBL9326675 0.89 RNASE1 (0.82) RNASE1TK1
SCHEMBL13273344 0.89 RNASE1 (0.68) RNASE1POLBTYMS
SCHEMBL21886791 0.89 RNASE1 (0.82) RNASE1TK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1204415-A2 5-(E)-BROMOVINYL URACIL ANALOGUES AND RELATED PYRIMIDINE NUCLEOSIDES AS ANTI-VIRAL AGENTS AND METHODS OF USE YALE UNIVERSITY (US) 2002-05-15 EP disclosed
WO-2001006986-A2 5-(E)-BROMOVINYL URACIL ANALOGUES AND RELATED PYRIMIDINE NUCLEOSIDES AS ANTI-VIRAL AGENTS AND METHODS OF USE YALE UNIVERSITY (US) 2001-02-01 WO disclosed