SCHEMBL12718545

SCHEMBL12718545

C=C1NC(=O)C(C)=CN1[C@@H]1O[C@H](CO)C(O)[C@H]1OCCF

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TK2 O00142 2/20 0.35
▸ LGALS1 P09382 2/20 0.33
▸ LGALS3 P17931 2/20 0.33
▸ LGALS9 O00182 1/20 0.33
▸ CDA P32320 4/20 0.32
▸ SLC28A1 O00337 1/20 0.32
▸ SLC28A2 O43868 1/20 0.32
▸ SLC29A1 Q99808 1/20 0.32
▸ SLC28A3 Q9HAS3 1/20 0.32
▸ GMNN O75496 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ NFKB1 P19838 1/20 0.31
▸ DNMT1 P26358 1/20 0.31
▸ THPO P40225 1/20 0.31
▸ MTOR P42345 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ BLM P54132 1/20 0.31

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
SCHEMBL20750703 0.87 DYRK1A (0.36) TK2LGALS1LGALS3LGALS9CDA
SCHEMBL25458682 0.83 CDA (0.42) CDASLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL12718550 0.78 RNASE1 (0.35) LMNABLMPMP22
SCHEMBL18016507 0.78 ADORA3 (0.36) CDASLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL18016510 0.75 CHEK1 (0.34) CDASLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL12718571 0.73 RNASE1 (0.34) LMNA
SCHEMBL26421873 0.72 TK2 (0.35) TK2CDASLC28A1SLC28A2SLC29A1
SCHEMBL17732554 0.72 CDA (0.42) CDASLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL12749200 0.70 TK2 (0.65) TK2ALDH1A1LMNABLM
SCHEMBL12718467 0.70 TK2 (0.65) TK2ALDH1A1LMNABLM

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
US-7928210-B2 Nucleoside based proliferation imaging markers SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2011-04-19 — — US disclosed
US-20090016958-A1 Nucleoside based proliferation imaging markers SIEMENS MEDICAL SOLUTIONS USA, INC. 2009-01-15 — — 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 (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-20090016958-A1 Nucleoside based proliferation imaging markers MKI67, SLC29A1, SLC29A2 TK2 20/4885LGALS1 1094/4885LGALS3 1476/4885

“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.

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