SCHEMBL22923477

SCHEMBL22923477

CCC(N)CNCC(=O)c1ccnc(-c2cnn3ccc(-c4cccs4)nc23)c1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 20/20 0.64
KCNH2 Q12809 4/20 0.64

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
SCHEMBL20186497 0.89 CAMK2D (0.78) CAMK2DKCNH2
SCHEMBL20186797 0.82 CAMK2D (0.80) CAMK2DKCNH2
SCHEMBL20186800 0.82 CAMK2D (0.80) CAMK2DKCNH2
SCHEMBL20202099 0.80 CAMK2D (0.70) CAMK2DKCNH2
SCHEMBL20186461 0.80 CAMK2D (0.68) CAMK2DKCNH2
SCHEMBL20225293 0.80 CAMK2D (0.73) CAMK2DKCNH2
SCHEMBL20186375 0.80 CAMK2D (0.68) CAMK2DKCNH2
SCHEMBL20186666 0.80 CAMK2D (0.75) CAMK2DKCNH2
SCHEMBL20186367 0.80 CAMK2D (0.75) CAMK2DKCNH2
SCHEMBL20186370 0.80 CAMK2D (0.75) 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
EP-3548495-B1 PYRAZOLOPYRIMIDINE DERIVATIVES AS CAM KINASE INHIBITORS GILEAD SCIENCES INC (US) 2021-01-27 EP disclosed