SCHEMBL4760384

SCHEMBL4760384

C[S+]([O-])c1ncc2c(I)nn(COCC[Si](C)(C)C)c2n1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.30

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
SCHEMBL24122074 0.81 DGAT1 (0.32) DGAT1
SCHEMBL4014856 0.79 DGAT1 (0.31) DGAT1
SCHEMBL4019286 0.77 DGAT1 (0.33) DGAT1
SCHEMBL16370085 0.73 DGAT1 (0.33) DGAT1
SCHEMBL25344551 0.72 NPC1 (0.33) DGAT1
SCHEMBL29900915 0.71 DGAT1 (0.38) DGAT1
SCHEMBL27215111 0.71 DGAT1 (0.38) DGAT1
SCHEMBL19250755 0.71 NPC1 (0.32) DGAT1
SCHEMBL1593371 0.71 DGAT1 (0.38) DGAT1
SCHEMBL17837426 0.71 NPC1 (0.38) DGAT1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1919470-A1 FUSED PYRAZOLE AS p38 MAP KINASE INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2008-05-14 EP disclosed
WO-2007023105-A1 FUSED PYRAZOLE AS p38 MAP KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2007-03-01 WO disclosed