SCHEMBL2372439

SCHEMBL2372439

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

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSL P07711 10/20 0.53
CTSS P25774 6/20 0.48
CTSK P43235 5/20 0.48
CTSB P07858 2/20 0.48
PSMB5 P28074 2/20 0.47
MME P08473 1/20 0.46
MMP2 P08253 2/20 0.46
MMP9 P14780 2/20 0.46
MMP8 P22894 2/20 0.46
MMP1 P03956 1/20 0.46
MMP3 P08254 1/20 0.46
MMP7 P09237 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
SCHEMBL8330748 0.87 ACE (0.60) CTSLCTSSCTSBPSMB5MME
SCHEMBL16468938 0.85 CTSL (0.55) CTSLCTSSCTSKMME
SCHEMBL7410124 0.84 CTSL (0.58) CTSLCTSSCTSBPSMB5MME
SCHEMBL1795838 0.82 CTSL (0.60) CTSLCTSSCTSKMME
SCHEMBL8530975 0.82 CTSL (0.62) CTSLCTSSCTSKMME
SCHEMBL4957095 0.81 CTSL (0.58) CTSLCTSSCTSKMME
SCHEMBL8526731 0.80 CTSL (0.57) CTSLCTSSCTSKCTSBMME
SCHEMBL8529162 0.78 CTSL (0.55) CTSLCTSSCTSKMME
SCHEMBL20609249 0.78 CTSK (0.73) CTSLCTSSCTSKCTSB
SCHEMBL20609250 0.78 CTSK (0.73) CTSLCTSSCTSKCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3322435-A1 PHARMACEUTICAL COMPOSITIONS USEFUL FOR THE TREATMENT OF TISSUE INJURY Medregen, LLC (US) 2018-05-23 EP disclosed
WO-2017011750-A1 PHARMACEUTICAL COMPOSITIONS USEFUL FOR THE TREATMENT OF TISSUE INJURY MEDREGEN, LLC (US) 2017-01-19 WO disclosed
EP-3030232-A2 WOUND HEALING VIA AUTOLOGOUS STEM CELL MOBILIZATION The Johns Hopkins University (US) 2016-06-15 EP disclosed
WO-2014179266-A2 WOUND HEALING VIA AUTOLOGOUS STEM CELL MOBILIZATION THE JOHNS HOPKINS UNIVERSITY (US) 2014-11-06 WO disclosed
EP-2549992-A2 METHODS OF TREATMENT USING STEM CELL MOBILIZERS The Johns Hopkins University (US) 2013-01-30 EP disclosed
WO-2011119738-A2 METHODS OF TREATMENT USING STEM CELL MOBILIZERS THE JOHNS HOPKINS UNIVERSITY (US) 2011-09-29 WO disclosed