SCHEMBL25325929

SCHEMBL25325929

CC(C)C(=O)N1C[C@H](c2cccc(Cl)c2)N(C(=O)O)C[C@H]1C

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.40
ADAM17 P78536 3/20 0.39
PDE5A O76074 1/20 0.38
KIF11 P52732 3/20 0.38
ALOX5 P09917 1/20 0.38
TP53 P04637 1/20 0.37
MDM2 Q00987 1/20 0.37
MAOA P21397 2/20 0.37
MAOB P27338 2/20 0.37
SLC6A9 P48067 1/20 0.36
FFAR2 O15552 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
SCHEMBL25327914 0.87 KIF11 (0.44) RIPK1KIF11
SCHEMBL25327034 0.86 SLC6A9 (0.39) RIPK1PDE5AKIF11SLC6A9
SCHEMBL30522928 0.85 RIPK1 (0.40) RIPK1PDE5ATP53MDM2MAOA
SCHEMBL30522979 0.85 RIPK1 (0.40) RIPK1PDE5ATP53MDM2MAOA
SCHEMBL25324773 0.85 RIPK1 (0.40) RIPK1PDE5ATP53MDM2MAOA
SCHEMBL25324778 0.85 RIPK1 (0.40) RIPK1PDE5ATP53MDM2MAOA
SCHEMBL25324582 0.84 DPP4 (0.36) MDM2
SCHEMBL25327435 0.83 RIPK1 (0.53) RIPK1PDE5AKIF11ALOX5MAOA
SCHEMBL25328377 0.80 TMEM97 (0.45) SLC6A9
SCHEMBL25326844 0.79 RIPK1 (0.37) RIPK1PDE5AMAOAMAOBSLC6A9

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