SCHEMBL5706343

SCHEMBL5706343

CN(Cc1cccc(C#C[SiH](C)C)c1)C1CC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.46
DPP9 Q86TI2 2/20 0.46
DPP7 Q9UHL4 2/20 0.46
GRIN2B Q13224 1/20 0.39
PTGES O14684 6/20 0.38
HRH4 Q9H3N8 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
SLC6A4 P31645 4/20 0.38
SLC6A2 P23975 3/20 0.38
SLC6A3 Q01959 3/20 0.38
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
PARP1 P09874 1/20 0.35

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
SCHEMBL4513889 0.81 DPP4 (0.46) DPP4DPP9DPP7GRIN2BPTGES
SCHEMBL4514422 0.80 DPP4 (0.47) DPP4DPP9DPP7GRIN2BPTGES
SCHEMBL5706324 0.77 HRH3 (0.40) DPP4DPP9DPP7GRIN2BHRH4
SCHEMBL5706358 0.75 JAK1 (0.34)
SCHEMBL4523863 0.71 FFAR1 (0.53) PTGESSLC6A4SLC6A2SLC6A3
SCHEMBL4523880 0.71 FFAR1 (0.53) PTGESSLC6A4SLC6A2SLC6A3
SCHEMBL5706341 0.71 PTGES (0.44) PTGES
SCHEMBL4169205 0.71 SIGMAR1 (0.49) DPP4DPP9DPP7GRIN2BHRH4
SCHEMBL13232926 0.71 SLC6A3 (0.57) DPP4DPP9DPP7GRIN2BHRH4
SCHEMBL4521338 0.70 PTGES (0.45) DPP4DPP9DPP7PTGESSLC6A4

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-1696899-A1 METHODS FOR TREATING RETINOID RESPONSIVE DISORDERS USING SELECTIVE INHIBITORS OF CYP26A AND CYP26B ALLERGAN, INC. (US) 2006-09-06 EP disclosed
WO-2005058301-A1 METHODS FOR TREATING RETINOID RESPONSIVE DISORDERS USING SELECTIVE INHIBITORS OF CYP26A AND CYP26B ALLERGAN, INC. (US) 2005-06-30 WO disclosed