SCHEMBL25327299

SCHEMBL25327299

C[C@@H]1CN(C(=O)O)[C@@H](c2ccccc2)CN1C(=O)C(C)(C)CN(C)C

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 14/20 0.45
PDK1 Q15118 1/20 0.42
PDK2 Q15119 1/20 0.42
PDK3 Q15120 1/20 0.42
PDK4 Q16654 1/20 0.42
SIGMAR1 Q99720 1/20 0.40

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
SCHEMBL25328631 0.89 RIPK1 (0.42) RIPK1PDK1PDK2PDK3PDK4
SCHEMBL25325079 0.88 NR1H2 (0.43) RIPK1PDK1PDK2PDK3PDK4
SCHEMBL25325076 0.88 NR1H2 (0.43) RIPK1PDK1PDK2PDK3PDK4
SCHEMBL25327354 0.84 RIPK1 (0.58) RIPK1PDK1PDK2PDK3PDK4
SCHEMBL25323657 0.82 PDK1 (0.39) RIPK1PDK1PDK2PDK3PDK4
SCHEMBL25326988 0.80 RIPK1 (0.53) RIPK1PDK1PDK2PDK3PDK4
SCHEMBL30523075 0.79 NR1H2 (0.38) RIPK1PDK1PDK2PDK3PDK4
SCHEMBL25327967 0.79 RIPK1 (0.41) RIPK1PDK1PDK2PDK3PDK4
SCHEMBL25328385 0.77 POLB (0.50) RIPK1
SCHEMBL25328383 0.77 POLB (0.50) RIPK1

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