SCHEMBL31111773

SCHEMBL31111773

C[Si](C)(C)CCOCn1cc(-c2cccc(N)c2F)c(-c2ccncc2)n1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 6/20 0.37
MAPK13 O15264 1/20 0.36
CSNK1D P48730 1/20 0.36
CSNK1E P49674 1/20 0.36
MAPK12 P53778 1/20 0.36
MAPK11 Q15759 1/20 0.36
MAPK14 Q16539 1/20 0.36
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34

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
SCHEMBL31111744 0.81 PDE10A (0.33) PDE10AMAPK13CSNK1DCSNK1EMAPK12
SCHEMBL31074565 0.81 MAPK14 (0.34) PDE10AMAPK13CSNK1DCSNK1EMAPK12
SCHEMBL29280467 0.77 BRAF (0.44) PDE10AMAPK13CSNK1DCSNK1EMAPK12
SCHEMBL26453172 0.76 S1PR1 (0.35) PDE10A
SCHEMBL1847543 0.76 BRAF (0.39) PDE10AMAPK14
SCHEMBL26453167 0.75 PTGIR (0.37) PDE10A
SCHEMBL31111573 0.74 DGAT1 (0.37) PDE10AMAPK13CSNK1DCSNK1EMAPK12
SCHEMBL1846834 0.74 BRAF (0.37) PDE10AMAPK14
Lithium Ion SCHEMBL1846833 0.73 BRAF (0.37) PDE10AMAPK14
SCHEMBL574873 0.73 BRAF (0.42) MAPK13CSNK1DCSNK1EMAPK12MAPK11

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-2024227104-A1 BIFUNCTIONAL COMPOUNDS FOR DEGRADING BRAF VIA UBIQUITIN PROTEOSOME PATHWAY NURIX THERAPEUTICS, INC. (US) 2024-10-31 WO disclosed