SCHEMBL28501115

SCHEMBL28501115

Cc1cccc(C)c1-c1cc(Nc2nc(N3CCCC(NC(=O)O)C3)ncc2C(N)=O)cc(C(=O)N2CCOCC2)c1

nearest known ligand 0.83

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CAMK1D Q8IU85 16/20 0.83
▸ BTK Q06187 3/20 0.57
▸ LCK P06239 1/20 0.53
▸ JAK3 P52333 1/20 0.53

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
SCHEMBL23113334 0.92 CAMK1D (0.83) CAMK1DBTKLCK
SCHEMBL30022246 0.92 CAMK1D (0.77) CAMK1DBTKLCKJAK3
SCHEMBL24736224 0.91 CAMK1D (1.00) CAMK1D
SCHEMBL23113703 0.90 CAMK1D (0.83) CAMK1DBTKLCK
SCHEMBL23113652 0.87 CAMK1D (0.81) CAMK1DBTKLCKJAK3
SCHEMBL30022498 0.85 CAMK1D (0.75) CAMK1DBTKLCK
SCHEMBL23113549 0.84 CAMK1D (0.87) CAMK1D
SCHEMBL28496606 0.83 CAMK1D (1.00) CAMK1D
SCHEMBL23113326 0.83 CAMK1D (1.00) CAMK1D
SCHEMBL30022458 0.82 CAMK1D (0.76) CAMK1DBTK

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
CN-112119077-A Kinase inhibitors 曼彻斯特大学 2020-12-22 — — CN disclosed
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