SCHEMBL18630543

SCHEMBL18630543

NS(=O)(=O)OC1[C@H]2O[C@@H](n3cnc4c(Cc5ccc(F)cc5)ncnc43)[C@H](O)[C@@]12O

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SLC29A1 Q99808 5/20 0.41
▸ ADORA2A P29274 3/20 0.38
▸ ATG7 O95352 1/20 0.38
▸ NNMT P40261 1/20 0.35
▸ ADORA2B P29275 1/20 0.34

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
SCHEMBL18630409 0.86 SLC29A1 (0.49) SLC29A1
SCHEMBL18631613 0.84 ATG7 (0.44) SLC29A1ADORA2AATG7
SCHEMBL18630436 0.80 UBA6 (0.40) SLC29A1ATG7
SCHEMBL1795883 0.78 ATG7 (0.57) SLC29A1ATG7
SCHEMBL11889887 0.78 ATG7 (0.57) SLC29A1ATG7
SCHEMBL18630609 0.78 HSP90B1 (0.36) ADORA2AATG7ADORA2B
SCHEMBL18630476 0.78 DNPH1 (0.49) —
SCHEMBL18631625 0.77 NNMT (0.40) SLC29A1NNMT
SCHEMBL18630477 0.76 CYP1A2 (0.40) ATG7NNMT
SCHEMBL18630483 0.76 ADK (0.37) SLC29A1ATG7

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-20170073367-A9 SUBSTITUTED PYRROLO[2,3-D]PYRIMIDINES MILLENIUM PHARMACEUTICALS, INC. 2017-03-16 — — 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-20170073367-A9 SUBSTITUTED PYRROLO[2,3-D]PYRIMIDINES TYMP, TYMS, PPA1 SLC29A1 1761/4885ADORA2A 1750/4885ATG7 2417/4885

“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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