SCHEMBL8905274

SCHEMBL8905274

CNC(=O)[C@@H](Cc1ccc(OC)cc1)N(C)C(=O)[C@@H](COCc1ccccc1)NC

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.44
MMP1 P03956 11/20 0.43
MMP9 P14780 6/20 0.43
MMP3 P08254 5/20 0.43
MMP8 P22894 1/20 0.43
MMP2 P08253 3/20 0.43
FPR2 P25090 1/20 0.42
MMP13 P45452 1/20 0.41

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
SCHEMBL6319189 0.93 MMP1 (0.42) MAOBMMP1MMP9MMP3MMP8
SCHEMBL8905743 0.85 MAOB (0.42) MAOBMMP1MMP9MMP3MMP8
SCHEMBL8905784 0.81 MMP1 (0.48) MMP1MMP9MMP3MMP8MMP2
SCHEMBL18603450 0.81 FPR2 (0.51) MMP1MMP9MMP3MMP2FPR2
SCHEMBL6326078 0.80 S1PR1 (0.39) MAOBMMP1MMP9MMP3MMP8
SCHEMBL6320157 0.80 KLKB1 (0.40) MAOBMMP1MMP9MMP3MMP2
SCHEMBL6319892 0.80 MMP1 (0.39) MAOBMMP1MMP9MMP3MMP2
SCHEMBL8206197 0.79 RAB9A (0.38) MAOBMMP1MMP9MMP3MMP2
SCHEMBL6317915 0.78 GHSR (0.46) MAOBMMP1MMP9MMP3
SCHEMBL6317908 0.78 GHSR (0.46) MAOBMMP1MMP9MMP3

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
WO-1997023508-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1997-07-03 WO claimed
WO-1997023508-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1997-07-03 WO disclosed