SCHEMBL6160926

SCHEMBL6160926

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

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACE P12821 3/20 0.62
NPSR1 Q6W5P4 1/20 0.56
CTSS P25774 3/20 0.55
CTSK P43235 2/20 0.55
CTSL P07711 1/20 0.55
CTSB P07858 1/20 0.55
MME P08473 1/20 0.54
ACE2 Q9BYF1 1/20 0.54
APP P05067 1/20 0.53
ATM Q13315 2/20 0.51
PPARA Q07869 2/20 0.51
PPARG P37231 1/20 0.51
KMT2A Q03164 1/20 0.50
ITGB3 P05106 1/20 0.50
ITGA2B P08514 1/20 0.50
MAPK1 P28482 1/20 0.49
KLK5 Q9Y337 1/20 0.49

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
SCHEMBL6160931 1.00 ACE (0.62) ACENPSR1CTSSCTSKCTSL
SCHEMBL8409581 0.94 ACE (0.64) ACENPSR1CTSSCTSKCTSL
SCHEMBL8409577 0.94 ACE (0.64) ACENPSR1CTSSCTSKCTSL
SCHEMBL6160820 0.90 PTPN1 (0.61) ACEMMEACE2PPARAPPARG
SCHEMBL6160810 0.90 PTPN1 (0.61) ACEMMEACE2PPARAPPARG
SCHEMBL8698935 0.88 CTSK (0.57) ACECTSSCTSKCTSLCTSB
SCHEMBL7370522 0.88 CTSK (0.57) ACECTSSCTSKCTSLCTSB
SCHEMBL5861728 0.87 CTSB (0.60) ACECTSSCTSKCTSLCTSB
SCHEMBL15576634 0.87 HDAC8 (0.59) ACECTSSCTSKCTSLCTSB
SCHEMBL9610767 0.87 HDAC8 (0.59) ACECTSSCTSKCTSLCTSB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0828754-B1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER (US) 2005-02-02 EP disclosed
US-5936089-A PIPERIDINE DERIVATIVES; BONE DISORDERS; OBESITY; AGING; CACHEXIA ASSOCIATED WITH AIDS AND CANCER PFIZER INC (US) 1999-08-10 US disclosed