SCHEMBL28447915

SCHEMBL28447915

Cc1cnc(Nc2ccc(C3CNCCO3)c(F)c2)nc1N1CCN(C(N)=O)CC1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 2/20 0.45
▸ JAK1 P23458 2/20 0.45
▸ TYK2 P29597 2/20 0.45
▸ JAK3 P52333 2/20 0.45

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
SCHEMBL28437334 0.89 JAK2 (0.42) JAK2JAK1TYK2JAK3
SCHEMBL28439357 0.88 JAK2 (0.51) JAK2
SCHEMBL28441102 0.87 — —
SCHEMBL28447910 0.79 JAK3 (0.65) JAK2JAK1TYK2JAK3
SCHEMBL28437347 0.78 JAK2 (0.50) JAK2JAK1TYK2JAK3
SCHEMBL28442019 0.78 — —
SCHEMBL28441106 0.78 JAK2 (0.49) JAK2JAK1TYK2JAK3
SCHEMBL28897516 0.77 PTK2 (0.60) JAK3
SCHEMBL28451616 0.77 — —
SCHEMBL28441100 0.73 JAK2 (0.61) JAK2JAK1TYK2JAK3

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
CN-111423384-A 2-aminopyrimidine compounds and application thereof 沈阳药科大学 2020-07-17 — — CN claimed
CN-111423384-B 2-aminopyrimidine compounds and application thereof 沈阳药科大学 2021-10-15 — — CN disclosed
CN-111423384-A 2-aminopyrimidine compounds and application thereof 沈阳药科大学 2020-07-17 — — CN disclosed
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