SCHEMBL9057982

SCHEMBL9057982

CCCOC(=O)C1(N)C=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C(=O)N1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 1/20 0.37
▸ ADORA2B P29275 1/20 0.37
▸ PYGM P11217 1/20 0.36
▸ CDA P32320 3/20 0.36
▸ SLC28A1 O00337 1/20 0.36
▸ SLC28A2 O43868 1/20 0.36
▸ SLC29A1 Q99808 1/20 0.36
▸ SLC28A3 Q9HAS3 1/20 0.36
▸ LMNA P02545 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ MTOR P42345 1/20 0.35
▸ MDM2 Q00987 1/20 0.35
▸ NCOA1 Q15788 1/20 0.35
▸ NCOA3 Q9Y6Q9 1/20 0.35

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
SCHEMBL9057960 0.87 SMN1; SMN2 (0.36) PYGMCDASLC28A1SLC28A2SLC29A1
SCHEMBL21357702 0.85 CDA (0.40) CDASLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL65271 0.85 CDA (0.40) CDASLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL9213688 0.84 SLC29A1 (0.44) ADORA2AADORA2BSLC28A1SLC28A2SLC29A1
SCHEMBL9368753 0.82 TK2 (0.40) CDALMNASMN1; SMN2
SCHEMBL8720503 0.82 CDA (0.38) CDASLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL9572140 0.82 TK2 (0.41) ADORA2AADORA2BCDA
SCHEMBL9572128 0.82 TK2 (0.41) ADORA2AADORA2BCDA
SCHEMBL9368671 0.82 TK2 (0.41) ADORA2AADORA2BCDA
SCHEMBL9572133 0.82 TK2 (0.41) ADORA2AADORA2BCDA

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
EP-0602454-B1 N-Oxycarbonyl substituted 5'-deoxy-5-fluorocytidines HOFFMANN LA ROCHE (CH) 1996-04-24 — — EP disclosed
EP-0602454-A1 N-Oxycarbonyl substituted 5'-deoxy-5-fluorocytidines F. HOFFMANN-LA ROCHE AG (CH) 1994-06-22 — — EP disclosed
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