SCHEMBL3266957

SCHEMBL3266957

CN(C)NC(=O)[C@@H](Cc1cccs1)N(C)C(=O)[C@@H](Cc1ccc2ccccc2c1)N(C)C(=O)OC(C)(C)C

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 8/20 0.49
CTSC P53634 1/20 0.43
CTSS P25774 2/20 0.40
CTSK P43235 2/20 0.40
CTSB P07858 1/20 0.40
BMP1 P13497 2/20 0.39
MMP9 P14780 1/20 0.36
MMP8 P22894 1/20 0.36

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
SCHEMBL8190649 0.89 GHSR (0.51) GHSRCTSCCTSSCTSKCTSB
SCHEMBL3274994 0.89 GHSR (0.51) GHSRCTSCCTSSCTSKCTSB
SCHEMBL3273825 0.89 GHSR (0.47) GHSRCTSSCTSKCTSBMMP9
SCHEMBL3266943 0.85 CTSK (0.47) CTSCCTSSCTSKBMP1
SCHEMBL3270415 0.85 GHSR (0.46) GHSRCTSCCTSSCTSKCTSB
SCHEMBL3268255 0.84 GHSR (0.61) GHSRCTSCCTSSCTSKCTSB
SCHEMBL3268247 0.84 GHSR (0.61) GHSRCTSCCTSSCTSKCTSB
SCHEMBL29958705 0.83 GHSR (0.72) GHSRCTSCBMP1MMP9MMP8
SCHEMBL14977964 0.83 GHSR (0.72) GHSRCTSCBMP1MMP9MMP8
SCHEMBL3266790 0.83 GHSR (0.72) GHSRCTSCBMP1MMP9MMP8

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1506969-B1 Compounds with growth hormone releasing properties HELSINN THERAPEUTICS US INC (US) 2010-06-09 EP disclosed
EP-1506969-A1 Compounds with growth hormone releasing properties NOVO NORDISK A/S (DK) 2005-02-16 EP disclosed
EP-1047709-B1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK AS (DK) 2004-11-03 EP disclosed
WO-1999036431-A9 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK AS (DK) 2000-07-27 WO disclosed