SCHEMBL11119944

SCHEMBL11119944

COCOC[C@H]1O[C@@H](n2cc(/C=C/Br)c(=O)[nH]c2=O)C[C@@H]1O

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TK1 P04183 3/20 0.71
CYP1A2 P05177 1/20 0.71
CYP3A4 P08684 1/20 0.71
TSHR P16473 1/20 0.71
BLM P54132 1/20 0.71
PMP22 Q01453 1/20 0.71
NPSR1 Q6W5P4 1/20 0.71
TYMS P04818 3/20 0.57
TK2 O00142 4/20 0.49

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
SCHEMBL11119954 1.00 TK1 (0.71) TK1CYP1A2CYP3A4TSHRBLM
SCHEMBL11119950 1.00 TK1 (0.71) TK1CYP1A2CYP3A4TSHRBLM
SCHEMBL11115921 0.91 TK1 (0.70) TK1CYP1A2CYP3A4TSHRBLM
SCHEMBL11115918 0.91 TK1 (0.70) TK1CYP1A2CYP3A4TSHRBLM
SCHEMBL11115926 0.91 TK1 (0.70) TK1CYP1A2CYP3A4TSHRBLM
SCHEMBL3084962 0.88 TK1 (0.74) TK1CYP1A2CYP3A4TSHRBLM
SCHEMBL11118574 0.88 TK1 (0.68) TK1CYP1A2CYP3A4TSHRBLM
SCHEMBL11118573 0.86 CYP1A2 (0.66) TK1CYP1A2CYP3A4TSHRBLM
SCHEMBL11118576 0.86 CYP1A2 (0.66) TK1CYP1A2CYP3A4TSHRBLM
SCHEMBL11201689 0.86 TK1 (0.68) TK1CYP1A2CYP3A4TSHRBLM

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
EP-0104857-A1 Deoxyuridine compounds, methods for preparing them and their use in medicine BEECHAM GROUP PLC (GB) 1984-04-04 EP disclosed