SCHEMBL12638751

SCHEMBL12638751

CC1=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C(=O)NC1N

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDA P32320 5/20 0.43
▸ SLC28A1 O00337 1/20 0.43
▸ SLC28A2 O43868 1/20 0.43
▸ SLC29A1 Q99808 1/20 0.43
▸ SLC28A3 Q9HAS3 1/20 0.43
▸ LMNA P02545 3/20 0.41
▸ MTOR P42345 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ THRB P10828 1/20 0.41
▸ MDM2 Q00987 1/20 0.41
▸ NCOA1 Q15788 1/20 0.41
▸ NCOA3 Q9Y6Q9 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ GMNN O75496 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ DNMT1 P26358 1/20 0.41
▸ THPO P40225 1/20 0.41
▸ HTT P42858 1/20 0.41

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
SCHEMBL10024110 0.89 CDA (0.46) CDASLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL14853698 0.86 PYGM (0.48) CDASLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL12638749 0.82 CDA (0.44) CDASLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL14145956 0.81 PYGM (0.41) CDASLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL17378037 0.77 PYGM (0.47) CDASLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL14853688 0.77 CDA (0.36) CDASLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL25492408 0.77 TK1 (0.44) LMNASMN1; SMN2DNMT1BLMPMP22
SCHEMBL17403368 0.77 TK1 (0.44) LMNASMN1; SMN2DNMT1BLMPMP22
SCHEMBL16198955 0.77 TLR7 (0.33) SLC29A1
SCHEMBL17409471 0.77 TK1 (0.44) LMNASMN1; SMN2DNMT1BLMPMP22

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8815848-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2014-08-26 — — US disclosed
US-20130142807-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2013-06-06 — — US disclosed
US-7947698-B2 Prevent trabsplant rejection; autoimmune diseases RIGEL PHARMACEUTICALS, INC. (US) 2011-05-24 — — US disclosed
US-20080279867-A1 Prevent trabsplant rejection; autoimmune diseases RIGEL PHARMACEUTICALS, INC. 2008-11-13 — — US 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 (2 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-20080279867-A1 Prevent trabsplant rejection; autoimmune diseases JAK3, JAK1, JAK2 CDA 2548/4885SLC28A1 3375/4885SLC28A2 3971/4885
US-20130142807-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 CDA 3158/4885SLC28A1 4462/4885SLC28A2 4413/4885

“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.

Send feedback