SCHEMBL21136376

SCHEMBL21136376

C[C@@]1(C#N)O[C@@H](c2csc3c(N)ncnc23)C(N=[N+]=[N-])[C@@H]1O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32

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
SCHEMBL19644599 0.85 HIF1A (0.35) HIF1AALDH1A1
SCHEMBL17453489 0.85 HIF1A (0.35) HIF1AALDH1A1
SCHEMBL21137110 0.84 HIF1A (0.33) HIF1AALDH1A1
SCHEMBL21137373 0.83 HIF1A (0.34) HIF1AALDH1A1
SCHEMBL21137370 0.82 HIF1A (0.34) HIF1AALDH1A1
SCHEMBL21136375 0.82 HIF1A (0.31) HIF1A
Phosphoric Acid SCHEMBL17453499 0.81 HIF1A (0.31) HIF1A
SCHEMBL19644632 0.80 HIF1A (0.35) HIF1AALDH1A1
SCHEMBL17453469 0.80 HIF1A (0.35) HIF1AALDH1A1
Phosphoric Acid SCHEMBL17453496 0.79 IRAK4 (0.32) —

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-20190194223-A1 THIENO[3,2-d]PYRIMIDINE, FURO[3,2-d]PYRIMIDINE, AND PYRROLO[3,2-D]PYRIMIDINES USEFUL FOR TREATING RESPIRATORY SYNCITIAL VIRUS INFECTIONS GILEAD SCIENCES, INC. 2019-06-27 — — 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-20190194223-A1 THIENO[3,2-d]PYRIMIDINE, FURO[3,2-d]PYRIMIDINE, AND PYRROLO[3,2-D]PYRIMIDINES USEFUL FOR TREATING RESPIRATORY SYNCITIAL VIRUS INFECTIONS DPYD, TYMS, TYMP HIF1A 2400/4885ALDH1A1 2169/4885

“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.

Send feedback