SCHEMBL14724951

SCHEMBL14724951

Nc1ncc2sc(=O)n(CC3C[C@H](O)[C@@H](CO)O3)c2n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 2/20 0.45
ADRB1 P08588 1/20 0.45
LMNA P02545 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
TP53 P04637 2/20 0.35
HTT P42858 2/20 0.35
PNP P00491 1/20 0.35
PDE4D Q08499 1/20 0.35
PDE3A Q14432 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
HBB P68871 2/20 0.35
ALDH1A1 P00352 2/20 0.35
GMNN O75496 1/20 0.35
NFKB1 P19838 1/20 0.35
THPO P40225 1/20 0.35
MTOR P42345 1/20 0.35
RAB9A P51151 1/20 0.35
BLM P54132 1/20 0.35
PMP22 Q01453 1/20 0.35
CYP1A2 P05177 1/20 0.34

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
SCHEMBL6970879 0.81 DNMT1 (0.55) DNMT1ADRB1LMNASMN1; SMN2TP53
SCHEMBL12808873 0.81 DNMT1 (0.55) DNMT1ADRB1LMNASMN1; SMN2TP53
SCHEMBL17822560 0.78 TLR7 (0.47) DNMT1ADRB1LMNATP53HTT
SCHEMBL6973748 0.78 TLR7 (0.47) DNMT1ADRB1LMNATP53HTT
SCHEMBL18948312 0.72 TLR7 (0.37) DNMT1ADRB1TLR7
SCHEMBL24728914 0.72 LMNA (0.53) DNMT1LMNASMN1; SMN2TP53HTT
SCHEMBL13845607 0.72 LMNA (0.53) DNMT1LMNASMN1; SMN2TP53HTT
SCHEMBL14725002 0.72 LMNA (0.53) DNMT1LMNASMN1; SMN2TP53HTT
SCHEMBL13272135 0.72 LMNA (0.53) DNMT1LMNASMN1; SMN2TP53HTT
SCHEMBL510423 0.72 LMNA (0.53) DNMT1LMNASMN1; SMN2TP53HTT

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-2561872-A1 3, 5-disubstituted and 3,5,7-trisubstituted-3H-oxazolo [4,5-d]pyrimidin-2-one compounds and prodrugs thereof Anadys Pharmaceuticals, Inc. (US) 2013-02-27 EP disclosed