SCHEMBL30339166

SCHEMBL30339166

Cc1ncc([C@@H]2CCON2)cc1F.Cc1ncc([C@@H]2CCON2C(=O)OC(C)(C)C)cc1F

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 5/20 0.34
PIK3R1 P27986 1/20 0.32
PIK3CA P42336 1/20 0.32
GPR119 Q8TDV5 3/20 0.30
DPP4 P27487 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
SCHEMBL29966680 0.91 RIPK1 (0.39) RIPK1PIK3R1PIK3CAGPR119DPP4
SCHEMBL22210862 0.91 RIPK1 (0.39) RIPK1PIK3R1PIK3CAGPR119DPP4
SCHEMBL28873169 0.91 RIPK1 (0.39) RIPK1PIK3R1PIK3CAGPR119DPP4
SCHEMBL30339051 0.85 NPSR1 (0.32)
SCHEMBL30339115 0.83 DGAT1 (0.35) GPR119
Trifluoroacetic Acid SCHEMBL30338762 0.81 NTRK1 (0.34)
Hydrochloric Acid SCHEMBL30338587 0.81 RIPK1 (0.38) RIPK1DPP4
SCHEMBL30338978 0.79 GPR119 (0.39) RIPK1GPR119
SCHEMBL30339304 0.79 GPR119 (0.34) RIPK1GPR119
SCHEMBL30339114 0.78 LMNA (0.30)

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
EP-4157835-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF SANOFI (FR) 2023-04-05 EP disclosed