SCHEMBL6600370

SCHEMBL6600370

CC(c1nnnn1CCc1ccccc1)N(C(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C)c1ccc2ccccc2c1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSS P25774 6/20 0.47
CTSB P07858 4/20 0.47
CTSK P43235 4/20 0.47
PTPN1 P18031 2/20 0.41
GHSR Q92847 3/20 0.39
ACE P12821 1/20 0.38
CTSL P07711 2/20 0.37
AKT1 P31749 1/20 0.37
MMP9 P14780 1/20 0.37
MMP8 P22894 1/20 0.37
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36
CCKAR P32238 3/20 0.35
CCKBR P32239 3/20 0.35
SCN9A Q15858 1/20 0.35

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
SCHEMBL6600367 0.83 CTSS (0.56) CTSSCTSBCTSKPTPN1GHSR
SCHEMBL6600601 0.83 GHSR (0.51) CTSSCTSBCTSKGHSRMEN1
SCHEMBL6600523 0.78 ALDH1A1 (0.43) MEN1ALDH1A1POLBKMT2A
SCHEMBL6589174 0.72 CTSS (0.64) CTSSCTSBCTSKPTPN1GHSR
SCHEMBL5552762 0.72 CTSS (0.64) CTSSCTSBCTSKPTPN1GHSR
SCHEMBL6600519 0.71 YAP1 (0.46) CTSSCTSBCTSKGHSRMEN1
SCHEMBL1519731 0.71 CTSS (0.74) CTSSCTSBCTSKPTPN1ACE
SCHEMBL3821361 0.71 CTSS (0.74) CTSSCTSBCTSKPTPN1ACE
SCHEMBL29436862 0.71 CTSS (0.74) CTSSCTSBCTSKPTPN1ACE
SCHEMBL29397962 0.71 CTSS (0.74) CTSSCTSBCTSKPTPN1ACE

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-0805816-B1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK AS (DK) 2004-07-28 EP disclosed
US-6350767-B1 GROWTH HORMONE RELEASE STIMULANT NOVO NORDISK A/S (DK) 2002-02-26 US disclosed
US-6013658-A ANIMAL GROWTH REGULATORS NOVO NORDISK A/S (DK) 2000-01-11 US disclosed
WO-1996022997-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1996-08-01 WO disclosed