SCHEMBL7646980

SCHEMBL7646980

CNC(=O)C(Cc1ccccc1)NC[C@@H](Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSS P25774 6/20 0.60
CTSK P43235 4/20 0.60
CTSB P07858 4/20 0.60
ATM Q13315 1/20 0.55
FCER2 P06734 2/20 0.52
APP P05067 4/20 0.52
CTSL P07711 2/20 0.48
PTPN1 P18031 1/20 0.48
ACE P12821 1/20 0.47
HDAC8 Q9BY41 1/20 0.46
MMP2 P08253 1/20 0.45
MMP9 P14780 1/20 0.45
MMP8 P22894 1/20 0.45
KLK5 Q9Y337 1/20 0.44
REN P00797 1/20 0.44
AKT1 P31749 1/20 0.43

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
SCHEMBL7646982 1.00 CTSS (0.60) CTSSCTSKCTSBATMFCER2
SCHEMBL7650106 0.87 FCER2 (0.59) CTSSCTSKCTSBFCER2CTSL
SCHEMBL7651306 0.87 FCER2 (0.59) CTSSCTSKCTSBFCER2CTSL
SCHEMBL5966507 0.86 CTSS (0.74) CTSSCTSKCTSBFCER2CTSL
SCHEMBL5557866 0.86 CTSS (0.74) CTSSCTSKCTSBFCER2CTSL
SCHEMBL7333181 0.81 ATM (0.70) CTSSCTSKCTSBATMAPP
SCHEMBL18645283 0.81 ATM (0.70) CTSSCTSKCTSBATMAPP
SCHEMBL7333186 0.81 ATM (0.70) CTSSCTSKCTSBATMAPP
SCHEMBL7366802 0.79 CTSS (0.60) CTSSCTSKCTSBFCER2CTSL
SCHEMBL14332332 0.79 CTSS (0.62) CTSSCTSKCTSBATMAPP

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-1184370-A2 Compounds with growth hormone releasing properties NOVO NORDISK A/S (DK) 2002-03-06 EP disclosed
US-6274584-B1 PEPTIDE DERIVATIVES; BIOAVAILABILITY; ENZYME RESISTANCE; MILK AND WOOL PRODUCTION NOVO NORDISK A/S (DK) 2001-08-14 US disclosed
US-6127354-A FOR TREATMENT OF GROWTH DISORDERS OR TO STIMULATE PRODUCTION OF WOOL OR MILK NOVO NORDISK A/S (DK) 2000-10-03 US disclosed
US-5922770-A NOVEL COMPOUNDS THAT STIMULATE THE RELEASE OF GROWTH HORMONE FROM THE PITUITARY NOVO NORDISK A/S (DK) 1999-07-13 US disclosed