SCHEMBL13930529

SCHEMBL13930529

O=C(NCc1ccc(C(=O)Nc2ncnc3c2ncn3[C@H]2C[C@@H](O)[C@@H](CO)O2)cc1)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SLC29A1 Q99808 1/20 0.52
▸ ADORA1 P30542 4/20 0.45
▸ ADORA3 P0DMS8 2/20 0.44
▸ ADORA2A P29274 2/20 0.44
▸ HIF1A Q16665 1/20 0.43
▸ ADORA2B P29275 1/20 0.42

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
SCHEMBL13375827 1.00 SLC29A1 (0.52) SLC29A1ADORA1ADORA3ADORA2AHIF1A
SCHEMBL13930566 1.00 SLC29A1 (0.52) SLC29A1ADORA1ADORA3ADORA2AHIF1A
SCHEMBL16417877 0.90 ADORA1 (0.42) SLC29A1ADORA1ADORA3ADORA2B
SCHEMBL16244658 0.89 SLC29A1 (0.52) SLC29A1ADORA1ADORA3ADORA2AHIF1A
SCHEMBL13375773 0.88 ADORA1 (0.44) ADORA1ADORA3ADORA2AADORA2B
SCHEMBL13213544 0.88 ADORA1 (0.39) SLC29A1ADORA1ADORA3ADORA2AADORA2B
SCHEMBL13930534 0.88 ADORA1 (0.39) SLC29A1ADORA1ADORA3ADORA2AADORA2B
SCHEMBL13930530 0.87 SLC29A1 (0.46) SLC29A1ADORA1ADORA3ADORA2AHIF1A
SCHEMBL13375777 0.87 SLC29A1 (0.46) SLC29A1ADORA1ADORA3ADORA2AHIF1A
SCHEMBL12724727 0.87 TYMP (0.46) SLC29A1ADORA1

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-20090053710-A1 FUNCTIONAL MOLECULE, FUNCTIONAL MOLECULE SYNTHESIZING AMIDITE AND TARGET SUBSTANCE ANALYSIS METHOD FUJITSU LIMITED (JP) 2009-02-26 — — 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-20090053710-A1 FUNCTIONAL MOLECULE, FUNCTIONAL MOLECULE SYNTHESIZING AMIDITE AND TARGET SUBSTANCE ANALYSIS METHOD TACR1, TACR2, ATIC SLC29A1 607/4885ADORA1 51/4885ADORA3 28/4885

“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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