SCHEMBL7705336

SCHEMBL7705336

CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CC(=O)NC1=O

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.53
CTSS P25774 3/20 0.52
CTSK P43235 3/20 0.52
CTSL P07711 2/20 0.52
CTSB P07858 1/20 0.52
CCKAR P32238 1/20 0.51
CCKBR P32239 1/20 0.51
ACE P12821 2/20 0.50
KLK5 Q9Y337 2/20 0.49
AKT1 P31749 1/20 0.48
IDO1 P14902 1/20 0.48
SCN9A Q15858 2/20 0.47
ATM Q13315 1/20 0.46
KLK7 P49862 2/20 0.46
KMT2A Q03164 1/20 0.46
APP P05067 1/20 0.46

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
SCHEMBL3870531 1.00 EPHX2 (0.53) EPHX2CTSSCTSKCTSLCTSB
SCHEMBL10629248 0.91 CTSS (0.52) EPHX2CTSSCTSKCTSLCTSB
SCHEMBL9797934 0.87 CTSL (0.57) CTSSCTSKCTSLCTSBIDO1
SCHEMBL10633866 0.85 CTSL (0.50) CTSSCTSKCTSLCTSBACE
SCHEMBL6454981 0.85 CTSL (0.50) CTSSCTSKCTSLCTSBACE
SCHEMBL8695509 0.83 IDO1 (0.41) CTSSCTSKCTSLCCKARCCKBR
SCHEMBL11030896 0.82 ACE (0.59) EPHX2CTSSCTSKCTSLCTSB
SCHEMBL27616185 0.82 ACE (0.59) EPHX2CTSSCTSKCTSLCTSB
SCHEMBL8577285 0.81 CTSL (0.46) CTSSCTSKCTSLCTSBIDO1
SCHEMBL10631067 0.81 CTSL (0.46) CTSSCTSKCTSLCTSBIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6342582-B1 PURIFICATION AND/OR BIOSYNTHESIS OF OLIGOPEPTIDES IN PRESENCE OF A PHENOL OR MIXTURE; DEBLOCKING, AMIDATION; VACCINES, DRUGS, FOOD, AGRICULTURE RHODIA CHIMIE (FR) 2002-01-29 US disclosed
US-5798443-A MEDIUM COMPRISING WATER IMMISCIBLE DILUENT AND HYDROXYAROMATIC COMPOUND RHONE-POULENC CHIMIE (FR) 1998-08-25 US disclosed
US-5789386-A WATER SOLUBLE ANTITUMOR AGENTS; INJECTABLE ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1998-08-04 US disclosed
EP-0266950-B1 Nor-statine and nor-cyclostatine polypeptides PFIZER (US) 1993-12-29 EP disclosed
US-5034376-A Nor-statine and nor-cyclostatine polypeptides PFIZER INC. (US) 1991-07-23 US disclosed
US-4935405-A Nor-statine and nor-cyclostatine polypeptides PFIZER INC. (US) 1990-06-19 US disclosed
US-4814342-A Nor-statine and nor-cyclostatine polypeptides PFIZER INC. (US) 1989-03-21 US disclosed
EP-0266950-A2 Nor-statine and nor-cyclostatine polypeptides PFIZER INC. (US) 1988-05-11 EP disclosed