SCHEMBL15949539

SCHEMBL15949539

C=C(C(N)=O)c1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)nc1N

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 9/20 0.56
ADRB1 P08588 1/20 0.56
DNMT3B Q9UBC3 4/20 0.51
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
PNP P00491 1/20 0.44
TP53 P04637 1/20 0.44
HTT P42858 1/20 0.44
PDE4D Q08499 1/20 0.44
PDE3A Q14432 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
FPR2 P25090 2/20 0.44
TK1 P04183 1/20 0.43

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
SCHEMBL5982106 0.92 DNMT1 (0.56) DNMT1ADRB1DNMT3BLMNASMN1; SMN2
SCHEMBL5982031 0.89 DNMT1 (0.58) DNMT1ADRB1DNMT3BLMNASMN1; SMN2
SCHEMBL5983240 0.89 DNMT1 (0.61) DNMT1ADRB1DNMT3BLMNASMN1; SMN2
SCHEMBL27093305 0.89 DNMT1 (0.61) DNMT1ADRB1DNMT3BLMNASMN1; SMN2
SCHEMBL5982088 0.89 DNMT1 (0.61) DNMT1ADRB1DNMT3BLMNASMN1; SMN2
SCHEMBL5983245 0.89 DNMT1 (0.61) DNMT1ADRB1DNMT3BLMNASMN1; SMN2
SCHEMBL5982356 0.87 DNMT1 (0.58) DNMT1ADRB1DNMT3BLMNASMN1; SMN2
SCHEMBL5982332 0.87 DNMT1 (0.58) DNMT1ADRB1DNMT3BLMNASMN1; SMN2
SCHEMBL11145607 0.87 DNMT1 (0.58) DNMT1ADRB1DNMT3BLMNASMN1; SMN2
SCHEMBL5982401 0.87 DNMT1 (0.58) DNMT1ADRB1DNMT3BLMNASMN1; 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
EP-2264044-B1 METHOD FOR DETECTION OF METHYLCYTOSINE USING PHOTORESPONSIVE PROBE JAPAN ADV INST SCIENCE & TECH (JP) 2014-08-20 EP disclosed