SCHEMBL9843870

SCHEMBL9843870

Cc1cn([C@H]2CC(F)[C@@H](COC(=O)C(C)(C)C)O2)c(=O)[nH]c1=O

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TK1 P04183 5/20 0.54
BCHE P06276 1/20 0.53
ABCG2 Q9UNQ0 3/20 0.52
ABCB1 P08183 1/20 0.52
RNASE1 P07998 1/20 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
SCHEMBL9843866 1.00 TK1 (0.54) TK1BCHEABCG2ABCB1RNASE1
SCHEMBL2056775 0.89 POLB (0.61) TK1BCHE
SCHEMBL8999366 0.89 POLB (0.61) TK1BCHE
SCHEMBL9156285 0.89 TK1 (0.57) TK1ABCG2ABCB1
SCHEMBL22512589 0.89 TK1 (0.57) TK1ABCG2ABCB1RNASE1
SCHEMBL9157298 0.89 TK1 (0.57) TK1ABCG2ABCB1
SCHEMBL9011675 0.89 TK1 (0.57) TK1ABCG2ABCB1
SCHEMBL12718357 0.88 TK1 (0.52) TK1BCHEABCG2ABCB1RNASE1
SCHEMBL19983719 0.88 ABCG2 (0.64) TK1ABCG2ABCB1
SCHEMBL9333405 0.87 BCHE (0.42) TK1BCHEABCG2

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-0450585-A2 Process for the manufacture of 2-deoxy-D-threo-pentofuranosides, intermediates for their manufacture and their use CHEMPROSA, CHEMISCHE PRODUKTE SAISCHEK GmbH (AT) 1991-10-09 EP disclosed