SCHEMBL7653844

SCHEMBL7653844

CC(C)(C)OC(=O)N[C@H](Cc1ccc2ccccc2c1)CS(=O)(=O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSS P25774 3/20 0.57
CTSK P43235 3/20 0.57
CTSB P07858 2/20 0.57
MMP13 P45452 4/20 0.50
ATM Q13315 1/20 0.49
PTPN1 P18031 1/20 0.47
ABCB1 P08183 1/20 0.45
BCL2 P10415 1/20 0.45
GABRB1 P18505 1/20 0.44
GABRB2 P47870 1/20 0.44
TACR1 P25103 1/20 0.43
MMP2 P08253 1/20 0.43
ACACB O00763 1/20 0.42
MMP1 P03956 1/20 0.42
MMP9 P14780 1/20 0.42
ADAM17 P78536 1/20 0.42
CA2 P00918 1/20 0.42
APP P05067 2/20 0.42
ALDH1A1 P00352 2/20 0.41
LMNA P02545 2/20 0.41

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
SCHEMBL7359719 0.88 ATM (0.62) CTSSCTSKCTSBMMP13ATM
SCHEMBL2736192 0.88 ATM (0.62) CTSSCTSKCTSBMMP13ATM
SCHEMBL739925 0.83 CTSS (0.62) CTSSCTSKCTSBATMPTPN1
SCHEMBL30753731 0.83 CTSS (0.62) CTSSCTSKCTSBATMPTPN1
SCHEMBL14332332 0.83 CTSS (0.62) CTSSCTSKCTSBATMPTPN1
SCHEMBL30753701 0.83 CTSS (0.62) CTSSCTSKCTSBATMPTPN1
SCHEMBL739924 0.83 CTSS (0.62) CTSSCTSKCTSBATMPTPN1
SCHEMBL7353984 0.83 CTSS (0.61) CTSSCTSKCTSBATMPTPN1
SCHEMBL31584190 0.83 CTSS (0.61) CTSSCTSKCTSBATMPTPN1
SCHEMBL31584006 0.82 CTSS (0.60) CTSSCTSKCTSBATMPTPN1

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
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
EP-0805816-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1997-11-12 EP disclosed
WO-1996022997-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1996-08-01 WO disclosed