SCHEMBL4444854

SCHEMBL4444854

C[CH]C(C)CCN(C)S(C)(=O)=O

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL4459410 0.78 MMP1 (0.36) MEN1KMT2A
SCHEMBL13553459 0.78 MEN1 (0.38) MEN1KMT2A
SCHEMBL15830080 0.74 TP53 (0.38) MEN1KMT2A
SCHEMBL13770844 0.74 CHRNB2 (0.39) MEN1KMT2A
SCHEMBL15384938 0.72 MEN1 (0.34) MEN1KMT2A
SCHEMBL13780657 0.71 MEN1 (0.33) MEN1KMT2A
SCHEMBL12967468 0.71 PSEN1 (0.34) MEN1KMT2A
SCHEMBL12967465 0.70 PSEN1 (0.37) MEN1KMT2A
SCHEMBL15384936 0.69 MEN1 (0.38) MEN1KMT2A
SCHEMBL15384963 0.68 LMNA (0.37) MEN1KMT2A

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
EP-2029153-A2 HEPATITIS C SERINE PROTEASE INHIBITORS AND USES THEREFOR Phenomix Corporation (US) 2009-03-04 EP claimed
WO-2007089618-A2 HEPATITIS C SERINE PROTEASE INHIBITORS AND USES THEREFOR PHENOMIX CORPORATION (US) 2007-08-09 WO claimed