SCHEMBL6300082

SCHEMBL6300082

CCc1ccc(Cn2cc(-c3cn([C@H]4C[C@H](O)[C@@H](CO)O4)c(=O)[nH]c3=O)nn2)cc1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TK1 P04183 2/20 0.53
TK2 O00142 1/20 0.53
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
TYMS P04818 1/20 0.50

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
SCHEMBL6294257 1.00 TK1 (0.53) TK1TK2LMNASMN1; SMN2TYMS
SCHEMBL6300119 0.93 TK1 (0.58) TK1TK2LMNASMN1; SMN2TYMS
SCHEMBL6294281 0.93 TYMS (0.58) TK1TK2LMNASMN1; SMN2TYMS
SCHEMBL6294280 0.93 TYMS (0.58) TK1TK2LMNASMN1; SMN2TYMS
SCHEMBL6295475 0.92 TK1 (0.54) TK1TK2LMNASMN1; SMN2
SCHEMBL6295474 0.92 TK1 (0.54) TK1TK2LMNASMN1; SMN2
SCHEMBL6295354 0.91 TYMS (0.56) TK1LMNASMN1; SMN2TYMS
SCHEMBL6295358 0.91 TYMS (0.56) TK1LMNASMN1; SMN2TYMS
SCHEMBL6295678 0.91 TK1 (0.54) TK1TK2LMNASMN1; SMN2
SCHEMBL6295468 0.90 TK1 (0.53) TK1TK2LMNASMN1; SMN2

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