SCHEMBL16730586

SCHEMBL16730586

CC(C)(C)NC(=O)N1CCn2nc(I)c(C(=O)N=O)c2C1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CSNK1E P49674 19/20 0.52
▸ CSNK1D P48730 18/20 0.52

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
SCHEMBL16700378 0.86 CSNK1E (0.57) CSNK1ECSNK1D
SCHEMBL16711439 0.85 CSNK1E (0.65) CSNK1ECSNK1D
SCHEMBL16728645 0.81 NR1H2 (0.36) CSNK1ECSNK1D
SCHEMBL16699925 0.81 CSNK1D (0.51) CSNK1ECSNK1D
SCHEMBL16699592 0.76 CSNK1E (0.51) CSNK1ECSNK1D
SCHEMBL16728630 0.69 ADORA1 (0.35) CSNK1ECSNK1D
SCHEMBL16708881 0.68 CSNK1D (1.00) CSNK1ECSNK1D
SCHEMBL16708874 0.68 CSNK1D (1.00) CSNK1ECSNK1D
SCHEMBL16708879 0.68 CSNK1D (1.00) CSNK1ECSNK1D
SCHEMBL16708887 0.68 CSNK1E (1.00) 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
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