SCHEMBL24554204

SCHEMBL24554204

CN1CCn2nc(-c3ccc(F)cc3)c(-c3ccnc(NC(=O)N(C)C)c3)c2C1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NR3C2 P08235 2/20 0.44
▸ MAPK14 Q16539 14/20 0.43
▸ MAPK10 P53779 2/20 0.43
▸ CSNK1D P48730 3/20 0.42
▸ MAPK13 O15264 1/20 0.42
▸ MAPK12 P53778 1/20 0.42
▸ KCNH2 Q12809 1/20 0.42
▸ MAPK11 Q15759 1/20 0.42
▸ GSK3B P49841 2/20 0.41
▸ PDE4A P27815 1/20 0.41
▸ PDE4B Q07343 1/20 0.41
▸ PDE4C Q08493 1/20 0.41
▸ PDE4D Q08499 1/20 0.41
▸ GRM5 P41594 2/20 0.40
▸ CSNK1E P49674 1/20 0.40

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
SCHEMBL29683408 1.00 NR3C2 (0.44) NR3C2MAPK14MAPK10CSNK1DMAPK13
SCHEMBL24553697 0.90 MAPK14 (0.53) MAPK14MAPK10CSNK1DMAPK13MAPK12
SCHEMBL29682944 0.90 MAPK14 (0.53) MAPK14MAPK10CSNK1DMAPK13MAPK12
SCHEMBL25223642 0.90 NR3C2 (0.46) NR3C2MAPK14MAPK10CSNK1DMAPK13
SCHEMBL24554205 0.88 NR3C2 (0.45) NR3C2MAPK14MAPK10CSNK1DMAPK13
SCHEMBL29683268 0.88 NR3C2 (0.45) NR3C2MAPK14MAPK10CSNK1DMAPK13
SCHEMBL24554208 0.87 MAPK14 (0.56) MAPK14MAPK10GSK3B
SCHEMBL24554150 0.87 NR3C2 (0.44) NR3C2MAPK14CSNK1DMAPK13MAPK12
SCHEMBL24554226 0.87 MAPK14 (0.46) NR3C2MAPK14CSNK1DMAPK13MAPK12
SCHEMBL24554207 0.87 NR3C2 (0.46) NR3C2MAPK14MAPK10CSNK1DMAPK13

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-2022127756-A1 COMPOUNDS AS CASEIN KINASE INHIBITORS Gritscience Biopharmaceuticals Co., Ltd. (CN) 2022-06-23 — — WO disclosed
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