SCHEMBL28057041

SCHEMBL28057041

CCC(C)(C)C(=O)N[C@H](C)C=O

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 4/20 0.42
CTSK P43235 3/20 0.35
CTSS P25774 1/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
CCR2 P41597 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
SCHEMBL749946 0.79 RIPK1 (0.47) RIPK1CTSKLMNAPOLBCCR2
SCHEMBL15083020 0.75 MMP1 (0.45) RIPK1
SCHEMBL15894960 0.75 MMP1 (0.45) RIPK1
SCHEMBL14712207 0.74 RIPK1 (0.42) RIPK1CTSK
SCHEMBL20047507 0.73 RIPK1 (0.47) RIPK1
SCHEMBL23175981 0.72 RIPK1 (0.42) RIPK1LMNAPOLB
SCHEMBL15895098 0.72 RIPK1 (0.42) RIPK1LMNAPOLB
SCHEMBL19449732 0.72 RIPK1 (0.42) RIPK1LMNAPOLBCCR2
SCHEMBL25748849 0.72 RIPK1 (0.42) RIPK1LMNAPOLBCCR2
SCHEMBL26428610 0.72 RIPK1 (0.42) RIPK1LMNAPOLBCCR2

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
CN-102574801-B Substituted aminopropionic acid derivatives as enkephalinase inhibitors NOVARTIS AG (CH) 2016-04-27 CN disclosed
CN-103896796-B As the alanine derivatives of the replacement of enkephalinase inhibitor NOVARTIS AG (CH) 2016-04-27 CN disclosed