SCHEMBL17382850

SCHEMBL17382850

Bc1c(-c2ccc(F)cc2)nn2c1CN(C(=O)OC(C)(C)C)CC2

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CSNK1E P49674 13/20 0.52
▸ CSNK1D P48730 9/20 0.52
▸ GRIA1 P42261 1/20 0.43
▸ MMP13 P45452 1/20 0.41
▸ CKS1B P61024 1/20 0.39
▸ SKP1 P63208 1/20 0.39
▸ SKP2 Q13309 1/20 0.39
▸ KDM1A O60341 1/20 0.39
▸ S1PR2 O95136 1/20 0.39

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
SCHEMBL16711450 0.87 CSNK1E (0.52) CSNK1ECSNK1DGRIA1MMP13
SCHEMBL17382842 0.87 CSNK1E (0.52) CSNK1ECSNK1DGRIA1MMP13CKS1B
SCHEMBL16711307 0.85 CSNK1E (0.71) CSNK1ECSNK1D
SCHEMBL16711215 0.84 CSNK1E (0.49) CSNK1ECSNK1DGRIA1
SCHEMBL26645681 0.83 CSNK1E (0.48) CSNK1ECSNK1DGRIA1CKS1BSKP1
SCHEMBL17926168 0.82 DPP4 (0.48) CSNK1ECSNK1DGRIA1CKS1BSKP1
SCHEMBL30623021 0.79 CSNK1E (0.44) CSNK1ECSNK1DGRIA1CKS1BSKP1
SCHEMBL26645795 0.79 CSNK1E (0.47) CSNK1ECSNK1DGRIA1
SCHEMBL30622765 0.79 CSNK1E (0.44) CSNK1ECSNK1DGRIA1
SCHEMBL30623115 0.79 CSNK1E (0.43) CSNK1ECSNK1DGRIA1

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-2015195880-A1 IMIDAZO-PYRIDAZNE DERIVATIVES AS CASEIN KINASE 1 DELTA/EPSILON INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2015-12-23 — — WO disclosed
Send feedback