SCHEMBL8905784

SCHEMBL8905784

CNC(=O)[C@@H](Cc1ccc(OC)cc1)N(C)C(=O)[C@@H](Cc1ccc2ccccc2c1)NC

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 8/20 0.48
MMP9 P14780 4/20 0.48
MMP13 P45452 1/20 0.48
ADAM17 P78536 1/20 0.48
MMP8 P22894 2/20 0.46
PIN1 Q13526 1/20 0.46
FCER2 P06734 1/20 0.46
F2 P00734 2/20 0.45
CTSL P07711 1/20 0.45
CTSS P25774 1/20 0.45
PTPN1 P18031 1/20 0.43
MMP2 P08253 1/20 0.43
FPR2 P25090 1/20 0.43
MMP3 P08254 2/20 0.42

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
SCHEMBL6317992 0.92 FCER2 (0.53) MMP9MMP8FCER2F2CTSL
SCHEMBL4426088 0.92 FCER2 (0.53) MMP9MMP8FCER2F2CTSL
SCHEMBL4427112 0.92 FCER2 (0.53) MMP9MMP8FCER2F2CTSL
SCHEMBL6318813 0.89 MMP9 (0.47) MMP9MMP8FCER2F2MMP2
SCHEMBL8711092 0.89 MMP9 (0.47) MMP9MMP8FCER2F2MMP2
SCHEMBL6320769 0.86 MMP9 (0.46) MMP9MMP8PIN1FCER2F2
SCHEMBL3266812 0.83 MMP9 (0.47) MMP9MMP8FCER2F2CTSL
SCHEMBL6316968 0.83 MMP9 (0.45) MMP9MMP8FCER2F2PTPN1
SCHEMBL6317658 0.83 MMP9 (0.45) MMP9MMP8FCER2F2PTPN1
SCHEMBL6324655 0.82 MME (0.47) MMP9MMP8FCER2F2CTSL

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