SCHEMBL16730669

SCHEMBL16730669

CC1(NC(=O)N2CCn3nc(-c4ccc(Cl)c(Cl)c4)c(C(=O)N=NN)c3C2)CC2(C1)CC2(F)F

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CSNK1E P49674 20/20 0.49
▸ CSNK1D P48730 16/20 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
SCHEMBL16700190 0.90 CSNK1E (0.61) CSNK1ECSNK1D
SCHEMBL16701042 0.83 CSNK1E (0.62) CSNK1ECSNK1D
SCHEMBL16711345 0.83 CSNK1E (0.63) CSNK1ECSNK1D
SCHEMBL16699934 0.80 CSNK1E (0.69) CSNK1ECSNK1D
SCHEMBL16699505 0.80 CSNK1E (0.63) CSNK1ECSNK1D
SCHEMBL16730588 0.79 CSNK1E (0.42) CSNK1ECSNK1D
SCHEMBL16699381 0.77 CSNK1E (0.64) CSNK1ECSNK1D
SCHEMBL16699420 0.77 CSNK1E (0.64) CSNK1ECSNK1D
SCHEMBL16711304 0.77 CSNK1E (0.64) CSNK1ECSNK1D
SCHEMBL16728786 0.76 CSNK1E (0.65) CSNK1ECSNK1D

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-2015073763-A1 SUBSTITUTED 4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRAZINE DERIVATIVES AS CASEIN KINASE 1 D/E INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2015-05-21 — — WO disclosed
Send feedback