SCHEMBL30455192

SCHEMBL30455192

Cn1cc(Nc2ncc(C(N)=O)c(NCc3cccnc3OC(C)(C)C)n2)cn1

nearest known ligand 0.82

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 20/20 0.82
▸ JAK2 O60674 7/20 0.68
▸ JAK1 P23458 9/20 0.62
▸ TYK2 P29597 3/20 0.58

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
SCHEMBL22261326 1.00 JAK3 (0.82) JAK3JAK2JAK1TYK2
SCHEMBL30455511 0.91 JAK3 (0.81) JAK3JAK2JAK1TYK2
SCHEMBL22261208 0.91 JAK3 (0.81) JAK3JAK2JAK1TYK2
SCHEMBL29622894 0.90 JAK3 (0.83) JAK3JAK2JAK1TYK2
SCHEMBL22261406 0.90 JAK3 (0.83) JAK3JAK2JAK1TYK2
SCHEMBL22261386 0.88 JAK3 (0.82) JAK3JAK2JAK1TYK2
SCHEMBL30455211 0.86 JAK3 (0.80) JAK3JAK2JAK1TYK2
SCHEMBL22261095 0.86 JAK3 (0.80) JAK3JAK2JAK1TYK2
SCHEMBL22261257 0.85 JAK3 (0.81) JAK3JAK2JAK1TYK2
SCHEMBL30454795 0.85 JAK3 (0.81) JAK3JAK2JAK1TYK2

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
EP-3686197-B1 2-SUBSTITUTED PYRAZOLE AMINO-4-SUBSTITUTED AMINO-5-PYRIMIDINE FORMAMIDE COMPOUND, COMPOSITION, AND APPLICATION THEREOF BEIJING SCITECH MQ PHARMACEUTICALS LTD (CN) 2023-06-21 — — EP disclosed
Send feedback