SCHEMBL18937285

SCHEMBL18937285

Nc1cc2c(ncn2[C@@H]2O[C@H](COP(=O)(O)O)[C@@H](OP(=O)(O)OC[C@@H]3C[C@@H](O)[C@H](n4cnc5c(=O)[nH]c(N)nc54)O3)[C@H]2O)c(=O)[nH]1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FUT5 Q11128 1/20 0.55
▸ TGM2 P21980 1/20 0.55
▸ NT5E P21589 1/20 0.53
▸ RNASEL Q05823 5/20 0.52
▸ P2RY2 P41231 1/20 0.52
▸ P2RY4 P51582 1/20 0.52
▸ P2RY6 Q15077 1/20 0.52
▸ IMPDH2 P12268 5/20 0.51
▸ TAS1R3 Q7RTX0 2/20 0.49
▸ TAS1R1 Q7RTX1 2/20 0.49
▸ KRAS P01116 2/20 0.49
▸ POLB P06746 1/20 0.49
▸ IMPDH1 P20839 1/20 0.49
▸ F2 P00734 1/20 0.49

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
SCHEMBL19448916 0.94 TGM2 (0.61) FUT5TGM2NT5ERNASELP2RY2
SCHEMBL21648046 0.94 TGM2 (0.61) FUT5TGM2NT5ERNASELP2RY2
SCHEMBL19185923 0.88 TGM2 (0.57) FUT5TGM2NT5ERNASELP2RY2
SCHEMBL25552773 0.88 TGM2 (0.60) FUT5TGM2NT5ERNASELP2RY2
SCHEMBL22142885 0.88 TGM2 (0.57) FUT5TGM2NT5ERNASELP2RY2
SCHEMBL18320601 0.85 NT5E (0.72) FUT5TGM2NT5ERNASELP2RY2
SCHEMBL23477028 0.85 FUT5 (0.58) FUT5TGM2NT5ERNASELP2RY2
SCHEMBL19186042 0.85 RNASEL (0.69) RNASEL
SCHEMBL18937290 0.85 RNASEL (0.69) RNASEL
SCHEMBL24771772 0.84 RNASEL (0.56) FUT5TGM2RNASEL

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-20170158724-A1 Novel Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-06-08 — — 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-20170158724-A1 Novel Compounds STING1, IRF3, IFNAR1 FUT5 4316/4885TGM2 3181/4885NT5E 2813/4885

“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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