SCHEMBL14178453

SCHEMBL14178453

Cc1ccc(S(=O)(=O)SCC(=O)NC2C(OP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(=O)[nH]c(N)nc54)C(O)C3O)OC(CO)C(O)C2O)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KRAS P01116 7/20 0.55
FUT5 Q11128 1/20 0.55
TGM2 P21980 1/20 0.55
P2RY2 P41231 2/20 0.55
P2RY4 P51582 2/20 0.55
P2RY6 Q15077 2/20 0.55
P2RY14 Q15391 1/20 0.54
NT5E P21589 1/20 0.49
FUT6 P51993 2/20 0.48
DCPS Q96C86 1/20 0.48
HINT1 P49773 2/20 0.48
PNP P00491 1/20 0.48

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
SCHEMBL14178456 0.88 KRAS (0.61) KRASFUT5TGM2P2RY2P2RY4
SCHEMBL14178454 0.87 KRAS (0.60) KRASFUT5TGM2P2RY2P2RY4
SCHEMBL29521199 0.87 P2RY2 (0.67) KRASFUT5TGM2P2RY2P2RY4
SCHEMBL14178448 0.86 FUT5 (0.63) KRASFUT5TGM2P2RY2P2RY4
SCHEMBL14178465 0.86 KRAS (0.64) KRASFUT5TGM2P2RY2P2RY4
SCHEMBL14178426 0.84 P2RY14 (0.76) P2RY2P2RY4P2RY6P2RY14
SCHEMBL14178455 0.84 KRAS (0.56) KRASFUT5TGM2P2RY2P2RY4
SCHEMBL14178449 0.84 KRAS (0.61) KRASFUT5TGM2P2RY2P2RY4
SCHEMBL29368655 0.82 FUT5 (0.72) KRASFUT5TGM2P2RY2P2RY4
SCHEMBL30973673 0.81 FUT5 (0.73) KRASFUT5TGM2P2RY2P2RY4

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-20080108557-A1 Modified Proteins NOVO NORDISK HEALTHCARE A/G (CH) 2008-05-08 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-20080108557-A1 Modified Proteins PTMS, DNPEP, STT3A KRAS 3761/4885FUT5 198/4885TGM2 111/4885

“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.