SCHEMBL24974343

SCHEMBL24974343

CC(C)Cc1cnn([C@@H](C)CC(C)C)c1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 6/20 0.36
JAK1 P23458 6/20 0.36
TYK2 P29597 6/20 0.36
JAK3 P52333 6/20 0.36
ACHE P22303 6/20 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
SCHEMBL24973989 1.00 JAK2 (0.36) JAK2JAK1TYK2JAK3ACHE
SCHEMBL21502005 0.88 JAK2 (0.37) JAK2JAK1TYK2JAK3ACHE
SCHEMBL24974345 0.85 ACHE (0.37) JAK2JAK1TYK2JAK3ACHE
SCHEMBL1106841 0.82 ACHE (0.41) ACHE
SCHEMBL24973991 0.79 JAK2 (0.30) JAK2JAK1TYK2JAK3
SCHEMBL21502007 0.79 JAK2 (0.30) JAK2JAK1TYK2JAK3
SCHEMBL24973093 0.78 JAK2 (0.32) JAK2JAK1TYK2JAK3
SCHEMBL22057991 0.77 JAK2 (0.38) JAK2JAK1TYK2JAK3ACHE
SCHEMBL19122852 0.77 JAK2 (0.38) JAK2JAK1TYK2JAK3ACHE
SCHEMBL19121741 0.76 JAK2 (0.40) JAK2JAK1TYK2JAK3ACHE

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 2 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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 JAK2 1041/4885JAK1 835/4885TYK2 1405/4885
US-20230312587-A1 PTERIDINONE COMPOUNDS AND USES THEREOF DPYD, PKD1, TYMP JAK2 1041/4885JAK1 835/4885TYK2 1405/4885

“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.