SCHEMBL5492363

SCHEMBL5492363

O=C(COc1ccccc1)Nc1nc2ncncc2[nH]1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.65
NPC1 O15118 4/20 0.65
SMN1; SMN2 Q16637 2/20 0.65
ALDH1A1 P00352 1/20 0.65
TP53 P04637 1/20 0.65
ALOX12 P18054 1/20 0.65
ALPL P05186 2/20 0.55
MAPT P10636 4/20 0.54
NOTUM Q6P988 1/20 0.49
LMNA P02545 1/20 0.49
GAA P10253 1/20 0.48
ADORA3 P0DMS8 1/20 0.46
ADORA2A P29274 1/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 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
SCHEMBL18912106 0.79 NPC1 (0.40) RAB9ANPC1SMN1; SMN2ALDH1A1TP53
SCHEMBL643747 0.79 NPC1 (1.00) RAB9ANPC1SMN1; SMN2ALDH1A1TP53
SCHEMBL18912105 0.77 NPC1 (0.44) RAB9ANPC1SMN1; SMN2ALDH1A1MAPT
SCHEMBL5495466 0.74 CYP3A4 (0.49) RAB9ANPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL16169 0.73 PI4KA (0.59) RAB9ASMN1; SMN2ALDH1A1TP53LMNA
SCHEMBL1970070 0.73 GDA (0.58) RAB9ANPC1SMN1; SMN2ALDH1A1TP53
SCHEMBL5196527 0.72 SPHK2 (0.58) RAB9ANPC1SMN1; SMN2ALDH1A1MAPT
SCHEMBL2429096 0.71 METAP2 (0.49) SMN1; SMN2MAPTLMNAGAAMEN1
SCHEMBL10644622 0.70 NPC1 (0.60) RAB9ANPC1SMN1; SMN2ALDH1A1TP53
SCHEMBL10774219 0.69 ENPP1 (0.36)

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 RAB9A 3754/4885NPC1 1394/4885SMN1; SMN2 1516/4885

“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.