SCHEMBL6294281

SCHEMBL6294281

Cc1ccc(Cn2cc(-c3cn([C@@H]4CC(O)[C@H](CO)O4)c(=O)[nH]c3=O)nn2)cc1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TYMS P04818 1/20 0.58
TK1 P04183 2/20 0.52
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
TK2 O00142 1/20 0.51

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
SCHEMBL6294280 1.00 TYMS (0.58) TYMSTK1LMNASMN1; SMN2TK2
SCHEMBL6300082 0.93 TK1 (0.53) TYMSTK1LMNASMN1; SMN2TK2
SCHEMBL6294257 0.93 TK1 (0.53) TYMSTK1LMNASMN1; SMN2TK2
SCHEMBL6300119 0.92 TK1 (0.58) TYMSTK1LMNASMN1; SMN2TK2
SCHEMBL6295354 0.91 TYMS (0.56) TYMSTK1LMNASMN1; SMN2
SCHEMBL6295358 0.91 TYMS (0.56) TYMSTK1LMNASMN1; SMN2
SCHEMBL6295474 0.90 TK1 (0.54) TK1LMNASMN1; SMN2TK2
SCHEMBL6295475 0.90 TK1 (0.54) TK1LMNASMN1; SMN2TK2
SCHEMBL6300338 0.90 TYMS (0.51) TYMSTK1LMNASMN1; SMN2TK2
SCHEMBL6300334 0.90 TYMS (0.51) TYMSTK1LMNASMN1; SMN2TK2

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-6884882-B1 2′-deoxyuridine derivatives and hydrogels formed therewith POSTECH FOUNDATION (KR) 2005-04-26 US disclosed