SCHEMBL6602012

SCHEMBL6602012

CC(C)(C=CC(=O)NC[C@@H](Cc1ccc2ccccc2c1)C(=O)NC[C@@H](Cc1ccccc1)c1nnc(C(N)=O)o1)NC(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSB P07858 1/20 0.39
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
ALDH1A1 P00352 6/20 0.35
HPGD P15428 5/20 0.35
HTT P42858 5/20 0.35
NPSR1 Q6W5P4 5/20 0.35
LMNA P02545 4/20 0.35
PKM P14618 3/20 0.35
HSD17B10 Q99714 3/20 0.35
TSHR P16473 3/20 0.35
TP53 P04637 2/20 0.35
MAPT P10636 2/20 0.35
AGTR1 P30556 1/20 0.35
RAB9A P51151 1/20 0.35
PTPRB P23467 2/20 0.34
KMT2A Q03164 2/20 0.33
XBP1 P17861 2/20 0.33
MEN1 O00255 1/20 0.33
ALOX15 P16050 1/20 0.33

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
SCHEMBL6602253 1.00 CTSB (0.39) CTSBCTSSCTSKALDH1A1HPGD
SCHEMBL6600524 0.90 CTSS (0.44) CTSBCTSSCTSKALDH1A1HPGD
SCHEMBL6600314 0.77 ALDH1A1 (0.48) CTSBCTSSCTSKALDH1A1HPGD
SCHEMBL6602015 0.77 GHSR (0.43) CTSBCTSSCTSKALDH1A1HPGD
SCHEMBL6602009 0.77 GHSR (0.43) CTSBCTSSCTSKALDH1A1HPGD
SCHEMBL7661248 0.75 CTSB (0.41) CTSBCTSSCTSKALDH1A1HPGD
SCHEMBL6323474 0.69 CTSS (0.44) CTSBCTSSCTSK
SCHEMBL6323483 0.69 CTSS (0.44) CTSBCTSSCTSK
SCHEMBL6600845 0.68 CTSS (0.47) CTSBCTSSCTSKALDH1A1HPGD
SCHEMBL6600836 0.68 CTSS (0.47) CTSBCTSSCTSKALDH1A1HPGD

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 3 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