SCHEMBL28552817

SCHEMBL28552817

O=c1[nH]c(=S)ccn1[C@H]1CC(O)[C@@H](CO)O1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TK1 P04183 3/20 0.59
▸ LMNA P02545 2/20 0.59
▸ SMN1; SMN2 Q16637 2/20 0.59
▸ ALOX12 P18054 1/20 0.56
▸ ADRA1A P35348 1/20 0.56
▸ TK2 O00142 1/20 0.55
▸ CYP1A2 P05177 1/20 0.54
▸ CYP3A4 P08684 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ BLM P54132 1/20 0.54
▸ PMP22 Q01453 1/20 0.54
▸ NPSR1 Q6W5P4 1/20 0.54

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
SCHEMBL440592 1.00 TK1 (0.59) TK1LMNASMN1; SMN2ALOX12ADRA1A
SCHEMBL8338549 1.00 TK1 (0.59) TK1LMNASMN1; SMN2ALOX12ADRA1A
SCHEMBL440591 1.00 TK1 (0.59) TK1LMNASMN1; SMN2ALOX12ADRA1A
Deoxyuridine SCHEMBL9219265 0.87 DUT (0.64) TK1LMNASMN1; SMN2ALOX12ADRA1A
Deoxyuridine SCHEMBL114598 0.87 DUT (0.64) TK1LMNASMN1; SMN2ALOX12ADRA1A
Deoxyuridine SCHEMBL24512520 0.87 DUT (0.64) TK1LMNASMN1; SMN2ALOX12ADRA1A
Deoxyuridine SCHEMBL9219261 0.87 DUT (0.64) TK1LMNASMN1; SMN2ALOX12ADRA1A
Deoxyuridine SCHEMBL28843 0.87 DUT (0.64) TK1LMNASMN1; SMN2ALOX12ADRA1A
Deoxyuridine SCHEMBL28844 0.87 DUT (0.64) TK1LMNASMN1; SMN2ALOX12ADRA1A
Deoxyuridine SCHEMBL4847464 0.87 DUT (0.64) TK1LMNASMN1; SMN2ALOX12ADRA1A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112745373-B Nucleic acid metabolism marker detection method based on 4-thionucleoside amine oxide degradation reaction and sequencing technology 清华大学 2023-03-21 — — CN disclosed
CN-112745373-A Nucleic acid metabolism marker detection method based on 4-thionucleoside amine oxide degradation reaction and sequencing technology 清华大学 2021-05-04 — — CN disclosed
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