SCHEMBL8450149

SCHEMBL8450149

CC(=O)Nc1ccccc1OC(=O)CCN(CC(C)C)C(=O)N[C@H](C(=O)O)C(Cc1ccccc1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.43
ACE P12821 3/20 0.43
CTSB P07858 1/20 0.39
LMNA P02545 3/20 0.39
RAB9A P51151 1/20 0.39
HSD17B10 Q99714 1/20 0.39
KMT2A Q03164 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
BRD4 O60885 1/20 0.37
FDFT1 P37268 1/20 0.36
ACACB O00763 2/20 0.35
ACACA Q13085 1/20 0.35
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
MEN1 O00255 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
SCHEMBL8451848 0.88 MME (0.46) MMEACECTSBFDFT1
SCHEMBL7568446 0.86 MME (0.59) MMEACECTSBLMNARAB9A
SCHEMBL8447157 0.86 MME (0.50) MMEACECTSBFDFT1ACACB
SCHEMBL8450012 0.85 MME (0.49) MMEACECTSBFDFT1ACACB
SCHEMBL8446467 0.84 MME (0.53) MMEACECTSBFDFT1
SCHEMBL8452068 0.84 MME (0.48) MMEACECTSBSMN1; SMN2FDFT1
SCHEMBL8446426 0.84 MME (0.48) MMEACECTSBFDFT1
SCHEMBL8451198 0.84 MME (0.48) MMEACECTSBRAB9AKMT2A
SCHEMBL8451834 0.83 MME (0.44) MMEACECTSBRAB9ASMN1; SMN2
SCHEMBL8447319 0.81 MME (0.51) MMEACECTSBFDFT1

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