SCHEMBL3270974

SCHEMBL3270974

CNNC(=O)[C@@H](Cc1ccccc1)N(C)C(=O)[C@@H](Cc1ccc2ccccc2c1)N(C)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 3/20 0.51
MMP9 P14780 1/20 0.43
MMP8 P22894 1/20 0.43
FCER2 P06734 1/20 0.43
MAOB P27338 1/20 0.41
CTSL P07711 1/20 0.41
CTSB P07858 1/20 0.41
CTSS P25774 1/20 0.41
ACHE P22303 1/20 0.40
MME P08473 1/20 0.40
ACE P12821 1/20 0.40
CPA1 P15085 1/20 0.40
ACE2 Q9BYF1 1/20 0.40
TACR1 P25103 2/20 0.40
MC4R P32245 2/20 0.40
MC5R P33032 2/20 0.40
MC3R P41968 2/20 0.40

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
SCHEMBL7065323 0.86 MMP9 (0.51) GHSRMMP9MMP8MAOBACHE
SCHEMBL7061723 0.85 GHSR (0.47) GHSRMMP9MMP8FCER2TACR1
SCHEMBL3266716 0.85 GHSR (0.47) GHSRMMP9MMP8FCER2CTSL
SCHEMBL8905746 0.83 GHSR (0.48) GHSRMMP9MMP8FCER2CTSL
SCHEMBL27495792 0.81 GHSR (0.49) GHSRMMP9MMP8FCER2MAOB
SCHEMBL6848992 0.80 MMP9 (0.46) GHSRMMP9MMP8FCER2CTSL
SCHEMBL6318047 0.80 GHSR (0.51) GHSRMMP9MMP8FCER2
SCHEMBL4427112 0.79 FCER2 (0.53) GHSRMMP9MMP8FCER2CTSL
SCHEMBL8100511 0.79 MC4R (0.50) GHSRMMP9MMP8FCER2MC4R
SCHEMBL4426088 0.79 FCER2 (0.53) GHSRMMP9MMP8FCER2CTSL

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
US-6083908-A TREATING MEDICAL DISORDERS RESULTING FROM DEFICIENCY IN GROWTH HORMONE NOVO NORDISK A/S (DK) 2000-07-04 US disclosed