SCHEMBL13329970

SCHEMBL13329970

NC1NC(=O)c2ncn([C@H]3C[C@@H](O)[C@@H](CO)O3)c2N1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRB1 P08588 1/20 0.56
▸ DNMT1 P26358 1/20 0.56
▸ ADA P00813 1/20 0.51
▸ ADORA3 P0DMS8 1/20 0.51
▸ ADORA2A P29274 1/20 0.51
▸ ADORA1 P30542 1/20 0.51
▸ PIM1 P11309 1/20 0.47
▸ CSNK2A2 P19784 1/20 0.47
▸ CSNK2B P67870 1/20 0.47
▸ CSNK2A1 P68400 1/20 0.47
▸ CSNK2A3 Q8NEV1 1/20 0.47
▸ LMNA P02545 3/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ PNP P00491 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ PDE4D Q08499 1/20 0.46
▸ PDE3A Q14432 1/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.46
▸ TK1 P04183 2/20 0.45

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
SCHEMBL13360824 1.00 ADRB1 (0.56) ADRB1DNMT1ADAADORA3ADORA2A
SCHEMBL20690125 0.90 DNMT1 (0.43) ADRB1DNMT1ADAADORA3ADORA2A
SCHEMBL1980882 0.83 ADRB1 (0.55) ADRB1DNMT1ADAADORA3ADORA2A
SCHEMBL1982812 0.82 ADRB1 (0.53) ADRB1DNMT1ADAADORA3ADORA2A
SCHEMBL16516763 0.77 ADRB1 (0.48) ADRB1DNMT1ADAADORA3ADORA2A
SCHEMBL18642548 0.76 ADRB1 (0.48) ADRB1DNMT1ADAADORA3ADORA2A
SCHEMBL4858615 0.74 ADRB1 (0.49) ADRB1DNMT1ADAADORA3ADORA2A
Decitabine SCHEMBL6674896 0.73 TK1 (0.58) ADRB1DNMT1ADAADORA3ADORA2A
SCHEMBL19417759 0.73 ATIC (0.54) DNMT1ADALMNASMN1; SMN2TP53
SCHEMBL3114372 0.72 TK1 (0.60) ADRB1DNMT1ADAADORA3ADORA2A

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-7723495-B2 Amidite for nucleic acid synthesis and nucleic acid synthesizing method FUJITSU LIMITED (JP) 2010-05-25 — — US disclosed
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