SCHEMBL20225331

SCHEMBL20225331

COCCNc1cc(C(=O)N(C)CC2CCC(C)N2)cc(-c2cnn3ccc(-c4cccs4)nc23)n1

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 20/20 0.62
KCNH2 Q12809 4/20 0.47

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
SCHEMBL22923602 0.89 CAMK2D (0.49) CAMK2DKCNH2
SCHEMBL22923530 0.84 CAMK2D (0.62) CAMK2DKCNH2
SCHEMBL20225614 0.79 CAMK2D (0.53) CAMK2DKCNH2
SCHEMBL20225367 0.79 CAMK2D (0.52) CAMK2DKCNH2
SCHEMBL22923484 0.78 CAMK2D (0.62) CAMK2DKCNH2
SCHEMBL20186835 0.77 CAMK2D (0.61) CAMK2DKCNH2
SCHEMBL20186770 0.77 CAMK2D (0.61) CAMK2DKCNH2
SCHEMBL22923495 0.77 CAMK2D (0.67) CAMK2DKCNH2
SCHEMBL20186712 0.77 CAMK2D (1.00) CAMK2DKCNH2
SCHEMBL20186714 0.77 CAMK2D (1.00) CAMK2DKCNH2

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
WO-2018102384-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AS CAM KINASE INHIBITORS GILEAD SCIENCES, INC. (US) 2018-06-07 WO disclosed