SCHEMBL25851327

SCHEMBL25851327

COP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O[PH](=O)OC[C@@H]1C[C@@H](O)[C@H](n2cnc3c(=O)[nH]c(N)nc32)O1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 1/20 0.52
▸ DTYMK P23919 4/20 0.52
▸ FUT5 Q11128 1/20 0.51
▸ P2RY1 P47900 3/20 0.50
▸ P2RY2 P41231 2/20 0.50
▸ NT5E P21589 1/20 0.50
▸ SRC P12931 1/20 0.50
▸ P2RX1 P51575 1/20 0.50
▸ P2RX3 P56373 1/20 0.50
▸ P2RX4 Q99571 1/20 0.50
▸ P2RX2 Q9UBL9 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ PARG Q86W56 1/20 0.48
▸ RNASEL Q05823 3/20 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
SCHEMBL23477159 0.92 RNASEL (0.56) TGM2DTYMKFUT5RNASEL
SCHEMBL24771772 0.92 RNASEL (0.56) TGM2DTYMKFUT5RNASEL
SCHEMBL19696038 0.87 RNASEL (0.61) RNASEL
SCHEMBL22080410 0.87 NT5E (0.51) TGM2DTYMKFUT5P2RY1P2RY2
SCHEMBL25552773 0.87 TGM2 (0.60) TGM2FUT5P2RY2NT5ERNASEL
SCHEMBL20762949 0.85 DNPH1 (0.55) DTYMKFUT5P2RY1P2RY2NT5E
SCHEMBL27378469 0.85 RNASEL (0.67) TGM2P2RY1P2RY2NT5ESRC
SCHEMBL19696031 0.85 DTYMK (0.62) DTYMKP2RY2RNASEL
SCHEMBL23477028 0.84 FUT5 (0.58) TGM2FUT5P2RY2NT5EP2RX3
SCHEMBL23476675 0.84 NT5E (0.53) TGM2FUT5P2RY2NT5E

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-20230227423-A1 SUBSTITUTED CONDENSED THIOPHENES AS MODULATORS OF STING CTXT PTY LTD (AU) 2023-07-20 — — 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-20230227423-A1 SUBSTITUTED CONDENSED THIOPHENES AS MODULATORS OF STING STING1, CGAS, IRF3 TGM2 3514/4885DTYMK 2045/4885FUT5 3130/4885

“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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