SCHEMBL21137072

SCHEMBL21137072

CC[C@]1(C)O[C@@H](c2csc3c(N)ncnc23)[C@H](Cl)[C@@H]1O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 1/20 0.33
▸ CSF1R P07333 1/20 0.31
▸ IRAK4 Q9NWZ3 1/20 0.31
▸ BRAF P15056 2/20 0.30

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
SCHEMBL21137374 0.91 HIF1A (0.33) HIF1ACSF1RIRAK4
SCHEMBL21137371 0.87 HIF1A (0.34) HIF1AIRAK4
SCHEMBL21136494 0.86 HIF1A (0.33) HIF1AIRAK4BRAF
SCHEMBL19644597 0.81 HIF1A (0.37) HIF1ACSF1R
SCHEMBL21137373 0.81 HIF1A (0.34) HIF1A
SCHEMBL21137368 0.80 HIF1A (0.33) HIF1AIRAK4
SCHEMBL19644583 0.79 HIF1A (0.39) HIF1AIRAK4
SCHEMBL21137365 0.79 HIF1A (0.33) HIF1AIRAK4BRAF
SCHEMBL17453461 0.79 HIF1A (0.35) HIF1A
SCHEMBL17453473 0.75 HIF1A (0.36) HIF1A

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 2400/4885CSF1R 2449/4885IRAK4 2655/4885

“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