SCHEMBL15533724

SCHEMBL15533724

O=c1[nH]cc(C2OC(CO)C(O)C23CCO3)c(=O)[nH]1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ ATAD2 Q6PL18 1/20 0.32
▸ CDA P32320 2/20 0.30
▸ LMNA P02545 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ TK1 P04183 1/20 0.30

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
SCHEMBL30504020 0.81 GAA (0.33) GAAMAPTATAD2
SCHEMBL766452 0.81 CDA (0.36) GAAMAPTCDALMNASMN1; SMN2
SCHEMBL860292 0.80 CDA (0.33) GAAMAPTATAD2CDALMNA
SCHEMBL31544543 0.78 GAA (0.31) GAAMAPTATAD2
SCHEMBL15810662 0.73 GAA (0.35) GAAMAPTATAD2LMNASMN1; SMN2
SCHEMBL23892079 0.72 TK1 (0.41) LMNASMN1; SMN2TK1
SCHEMBL12642442 0.72 TK1 (0.41) LMNASMN1; SMN2TK1
SCHEMBL658719 0.72 TK1 (0.41) LMNASMN1; SMN2TK1
SCHEMBL2641583 0.72 TK1 (0.41) LMNASMN1; SMN2TK1
SCHEMBL774016 0.71 PNP (0.44) MAPTLMNASMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3074412-A1 CRYSTAL FORM OF NUCLEOSIDE INHIBITOR OF HCV Janssen Sciences Ireland UC (IE) 2016-10-05 — — EP disclosed
WO-2015077966-A1 CRYSTAL FORM OF NUCLEOSIDE INHIBITOR OF HCV JANSSEN R&D IRELAND (IE) 2015-06-04 — — WO disclosed
EP-2861611-A1 URACYL SPIROOXETANE NUCLEOSIDES Janssen Sciences Ireland UC (IE) 2015-04-22 — — EP disclosed
WO-2013174962-A1 URACYL SPIROOXETANE NUCLEOSIDES JANSSEN R&D IRELAND (IE) 2013-11-28 — — WO disclosed
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