SCHEMBL28493012

SCHEMBL28493012

CN(C)C(=O)c1cccc(Nc2ccnc(N3CCCC(N)C3)n2)c1

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CAMK1D Q8IU85 19/20 0.70
▸ ROCK2 O75116 1/20 0.49

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
SCHEMBL28493008 1.00 CAMK1D (0.70) CAMK1DROCK2
SCHEMBL28509419 0.85 CAMK1D (0.70) CAMK1DROCK2
SCHEMBL28502200 0.83 CAMK1D (0.71) CAMK1D
SCHEMBL23113320 0.82 CAMK1D (1.00) CAMK1D
SCHEMBL23113317 0.82 CAMK1D (1.00) CAMK1D
SCHEMBL28496392 0.80 CAMK1D (0.67) CAMK1DROCK2
SCHEMBL28488319 0.76 CAMK1D (0.67) CAMK1DROCK2
SCHEMBL28488317 0.76 CAMK1D (0.67) CAMK1DROCK2
SCHEMBL28499446 0.76 CAMK1D (0.69) CAMK1DROCK2
SCHEMBL28499445 0.76 CAMK1D (0.69) CAMK1DROCK2

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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