SCHEMBL5492353

SCHEMBL5492353

O=C(COc1ccccc1)Nc1ncc2nc[nH]c2n1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.57
ADORA3 P0DMS8 4/20 0.54
ADORA2A P29274 4/20 0.54
SMN1; SMN2 Q16637 4/20 0.53
NPC1 O15118 6/20 0.51
RAB9A P51151 5/20 0.51
TP53 P04637 3/20 0.51
ALDH1A1 P00352 2/20 0.51
ALOX12 P18054 1/20 0.51
ADORA1 P30542 2/20 0.49
NOTUM Q6P988 1/20 0.48
ALPL P05186 1/20 0.48
LMNA P02545 2/20 0.48
THRB P10828 1/20 0.45
HPGD P15428 1/20 0.45
MEN1 O00255 1/20 0.45
POLB P06746 1/20 0.45
KMT2A Q03164 1/20 0.45
NPSR1 Q6W5P4 1/20 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
SCHEMBL25921184 0.79 GAA (0.56) GAAADORA3ADORA2ASMN1; SMN2NPC1
SCHEMBL4405832 0.78 CYP1A2 (0.50) GAAADORA3ADORA2ASMN1; SMN2NPC1
SCHEMBL30151959 0.76 SYK (0.34) GAASMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL6933552 0.73 ALPL (0.52) GAAADORA3ADORA2ASMN1; SMN2NPC1
SCHEMBL1019383 0.73 IP6K1 (0.47) ADORA3SMN1; SMN2RAB9ATP53ALDH1A1
SCHEMBL5196384 0.72 GDA (0.40) ADORA3SMN1; SMN2NPC1RAB9ATP53
SCHEMBL1970068 0.71 NPC1 (0.58) GAAADORA3ADORA2ASMN1; SMN2NPC1
SCHEMBL5465546 0.70 GAA (0.69) GAAADORA3ADORA2ASMN1; SMN2NPC1
SCHEMBL822367 0.69 NPC1 (0.75) GAAADORA3ADORA2ASMN1; SMN2NPC1
SCHEMBL3026520 0.69 CDK2 (0.60) NPC1RAB9AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1108724-B1 Synthesis of methoxy nucleosides and enzymatic nucleic acid molecules SIRNA THERAPEUTICS INC (US) 2007-09-19 EP disclosed
US-6972330-B2 Contacting N4-acetyl-5',3'-di-O-acetyl-2'-O- methyl cytidine with Lewis acid to form 2'-)-methyladenosine nucleoside which is converted to phosphoramidite SIRNA THERAPEUTICS, INC. (US) 2005-12-06 US disclosed
US-20030204078-A1 Chemical synthesis of methoxy nucleosides RIBOZYME PHARMACEUTICALS, INC. 2003-10-30 US disclosed
EP-1108724-A2 Synthesis of methoxy nucleosides and enzymatic nucleic acid molecules RIBOZYME PHARMACEUTICALS, INC. (US) 2001-06-20 EP disclosed
EP-0886641-A2 SYNTHESIS OF METHOXY NUCLEOSIDES AND ENZYMATIC NUCLEIC ACID MOLECULES RIBOZYME PHARMACEUTICALS, INC. (US) 1998-12-30 EP disclosed
WO-1997026270-A2 SYNTHESIS OF METHOXY NUCLEOSIDES AND ENZYMATIC NUCLEIC ACID MOLECULES RIBOZYME PHARMACEUTICALS, INC. (US) 1997-07-24 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030204078-A1 Chemical synthesis of methoxy nucleosides UMPS, PNP, NUDT1 GAA 1066/4885ADORA3 814/4885ADORA2A 543/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.