SCHEMBL31318296

SCHEMBL31318296

CCOC(C)n1cc(-c2ncn3nc(N)nc3c2OC(C)C(F)F)cn1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 3/20 0.40
JAK1 P23458 2/20 0.40
TYK2 P29597 2/20 0.40
JAK3 P52333 2/20 0.40
MAP3K5 Q99683 2/20 0.31
CD274 Q9NZQ7 1/20 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
SCHEMBL23209287 0.91 JAK2 (0.42) JAK2JAK1TYK2JAK3MAP3K5
SCHEMBL31318293 0.88 JAK2 (0.39) JAK2JAK1TYK2JAK3MAP3K5
SCHEMBL25226197 0.88 JAK2 (0.43) JAK2JAK1TYK2JAK3MAP3K5
SCHEMBL31423897 0.85 JAK2 (0.40) JAK2JAK1TYK2JAK3MAP3K5
SCHEMBL31423956 0.84 JAK2 (0.46) JAK2JAK1TYK2JAK3MAP3K5
SCHEMBL31423977 0.84 JAK2 (0.37) JAK2JAK1TYK2JAK3
SCHEMBL31318298 0.83 JAK2 (0.39) JAK2JAK1TYK2JAK3CD274
SCHEMBL31318294 0.83 JAK2 (0.39) JAK2JAK1TYK2JAK3CD274
SCHEMBL23209411 0.82 JAK2 (0.44) JAK2JAK1TYK2JAK3MAP3K5
SCHEMBL23209356 0.82 JAK2 (0.43) JAK2JAK1TYK2JAK3MAP3K5

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-20240415840-A1 BICYCLIC AMINES AS CDK2 INHIBITORS INCYTE CORPORATION 2024-12-19 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-20240415840-A1 BICYCLIC AMINES AS CDK2 INHIBITORS CDK2, CCNI, CDK1 JAK2 232/4885JAK1 605/4885TYK2 304/4885

“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.