SCHEMBL18785152

SCHEMBL18785152

Nc1nc2c(ncn2[C@H]2C[C@@H](O)C(COP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]1

nearest known ligand 0.82

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.82
P2RY2 P41231 2/20 0.73
P2RY4 P51582 2/20 0.73
P2RY6 Q15077 2/20 0.73
TGM2 P21980 1/20 0.61
FUT5 Q11128 1/20 0.59
KRAS P01116 2/20 0.58
NT5E P21589 2/20 0.56
PNP P00491 1/20 0.56
POLG P54098 1/20 0.55
DTYMK P23919 4/20 0.54
ENPP1 P22413 2/20 0.51
P2RY1 P47900 1/20 0.51
DCPS Q96C86 1/20 0.50

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
SCHEMBL2219689 1.00 POLB (0.82) POLBP2RY2P2RY4P2RY6TGM2
SCHEMBL18775385 1.00 POLB (0.82) POLBP2RY2P2RY4P2RY6TGM2
SCHEMBL157937 1.00 POLB (0.82) POLBP2RY2P2RY4P2RY6TGM2
SCHEMBL16699229 0.99 POLB (0.81) POLBP2RY2P2RY4P2RY6TGM2
Deoxyguanosine Triphosphate SCHEMBL2820367 0.99 POLB (0.81) POLBP2RY2P2RY4P2RY6TGM2
Deoxyguanosine Triphosphate SCHEMBL252797 0.99 POLB (0.81) POLBP2RY2P2RY4P2RY6TGM2
SCHEMBL3042901 0.99 POLB (0.81) POLBP2RY2P2RY4P2RY6TGM2
Deoxyguanosine Triphosphate SCHEMBL12729493 0.99 POLB (0.81) POLBP2RY2P2RY4P2RY6TGM2
Deoxyguanosine Triphosphate SCHEMBL18785123 0.99 POLB (0.81) POLBP2RY2P2RY4P2RY6TGM2
Deoxyguanosine Triphosphate SCHEMBL80609 0.99 POLB (0.81) POLBP2RY2P2RY4P2RY6TGM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170112948-A1 Inorganic-organic hybrid compound Karlsruher Institut für Technologie (DE) 2017-04-27 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-20170112948-A1 Inorganic-organic hybrid compound SLCO4C1, SLCO2A1, SLCO1A2 POLB 3337/4885P2RY2 1037/4885P2RY4 518/4885

“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.