SCHEMBL25327435

SCHEMBL25327435

C[C@@H]1CN(C(=O)O)[C@@H](c2cccc(Cl)c2)CN1C(=O)C(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 10/20 0.53
PDE5A O76074 1/20 0.43
PDK1 Q15118 1/20 0.39
PDK2 Q15119 1/20 0.39
PDK3 Q15120 1/20 0.39
PDK4 Q16654 1/20 0.39
ALOX5 P09917 1/20 0.38
MAOA P21397 2/20 0.37
MAOB P27338 2/20 0.37
KIF11 P52732 2/20 0.37
SLC6A9 P48067 1/20 0.36

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
SCHEMBL25326433 0.87 RIPK1 (0.50) RIPK1PDE5APDK1PDK2PDK3
SCHEMBL30522890 0.87 RIPK1 (0.50) RIPK1PDE5APDK1PDK2PDK3
SCHEMBL25325613 0.86 RIPK1 (0.49) RIPK1PDE5AMAOAMAOBKIF11
SCHEMBL30522916 0.86 RIPK1 (0.49) RIPK1PDE5AMAOAMAOBKIF11
SCHEMBL25325607 0.86 RIPK1 (0.49) RIPK1PDE5AMAOAMAOBKIF11
SCHEMBL25327354 0.86 RIPK1 (0.58) RIPK1PDK1PDK2PDK3PDK4
SCHEMBL25325898 0.86 RIPK1 (0.44) RIPK1PDE5APDK1PDK2PDK3
SCHEMBL25326988 0.84 RIPK1 (0.53) RIPK1PDK1PDK2PDK3PDK4
SCHEMBL25325929 0.83 RIPK1 (0.40) RIPK1PDE5AALOX5MAOAMAOB
SCHEMBL25326719 0.81 RIPK1 (0.44) RIPK1PDE5APDK1PDK2PDK3

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-2023146991-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 WO disclosed