SCHEMBL23634162

SCHEMBL23634162

CC(C)OC[C@@H]1CCC[C@@H](C(C)C)C1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33

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
SCHEMBL23917983 0.87 SLC1A3 (0.36) SLC1A3SLC1A2SLC1A1
SCHEMBL16192875 0.83 SHBG (0.31)
SCHEMBL10136484 0.83
SCHEMBL20021702 0.81
SCHEMBL19412476 0.79 MDM2 (0.31) SLC1A3SLC1A2SLC1A1
SCHEMBL16191176 0.79 SHBG (0.31)
SCHEMBL14265632 0.78 SLC1A3 (0.35) SLC1A3SLC1A2SLC1A1
SCHEMBL11965851 0.78 SLC1A3 (0.42) SLC1A3SLC1A2SLC1A1
SCHEMBL16191213 0.78 SHBG (0.37)
SCHEMBL18895814 0.77 SHBG (0.34)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230312587-A1 PTERIDINONE COMPOUNDS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED 2023-10-05 US disclosed
US-11572364-B2 Pteridinone compounds and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-02-07 US disclosed
US-11059826-B2 Pteridinone compounds and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2021-07-13 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 (3 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-11572364-B2 Pteridinone compounds and uses thereof DPYD, PKD1, TYMP SLC1A3 1414/4885SLC1A2 1587/4885SLC1A1 1073/4885
US-11059826-B2 Pteridinone compounds and uses thereof DPYD, PKD1, TYMP SLC1A3 1414/4885SLC1A2 1587/4885SLC1A1 1073/4885
US-20230312587-A1 PTERIDINONE COMPOUNDS AND USES THEREOF DPYD, PKD1, TYMP SLC1A3 1414/4885SLC1A2 1587/4885SLC1A1 1073/4885

“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.