SCHEMBL8447155

SCHEMBL8447155

COC(=O)CCN(CC(C)C)C(=O)N[C@@H](Cc1ccc(-c2ccccc2)cc1)C(=O)OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MME P08473 5/20 0.56
ACE P12821 5/20 0.56
CTSB P07858 1/20 0.50
HDAC1 Q13547 4/20 0.44
HDAC6 Q9UBN7 4/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TACR1 P25103 1/20 0.44
MBTPS1 Q14703 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL8452063 0.95 MME (0.57) MMEACECTSBHDAC1HDAC6
SCHEMBL8451194 0.95 MME (0.57) MMEACECTSBHDAC1HDAC6
SCHEMBL8450008 0.93 MME (0.55) MMEACECTSBHDAC1HDAC6
SCHEMBL8446466 0.93 MME (0.59) MMEACECTSBHDAC1HDAC6
SCHEMBL8446424 0.92 MME (0.54) MMEACECTSBHDAC1HDAC6
SCHEMBL8452065 0.92 MME (0.54) MMEACECTSBHDAC1HDAC6
SCHEMBL8451844 0.91 MME (0.51) MMEACECTSBHDAC1HDAC6
SCHEMBL8449573 0.91 MME (0.52) MMEACECTSBMEN1KMT2A
SCHEMBL8446430 0.90 MME (0.52) MMEACECTSBMEN1KMT2A
SCHEMBL8447317 0.90 MME (0.56) MMEACECTSBHDAC1HDAC6

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
US-5968980-A ENDOPEPTIDASE 24.11 INHIBITORS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1999-10-19 US disclosed