SCHEMBL27778950

SCHEMBL27778950

CCC(=O)N[C@@H](CSCc1ccccc1)C(=O)NCC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GLO1 Q04760 1/20 0.52
▸ ACE P12821 4/20 0.50
▸ PPARG P37231 1/20 0.45
▸ PPARA Q07869 1/20 0.45
▸ METAP2 P50579 1/20 0.42

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
SCHEMBL27778952 1.00 GLO1 (0.52) GLO1ACEPPARGPPARAMETAP2
SCHEMBL11573687 0.84 ACE (0.64) ACEPPARGPPARA
SCHEMBL9170095 0.82 GLO1 (0.49) GLO1ACEPPARGPPARA
SCHEMBL5000996 0.82 GLO1 (0.59) GLO1ACE
SCHEMBL11874436 0.82 GLO1 (0.59) GLO1ACE
SCHEMBL27800181 0.80 ACE (0.46) ACE
SCHEMBL27800184 0.80 ACE (0.46) ACE
SCHEMBL11880817 0.77 GLO1 (0.53) GLO1ACEMETAP2
SCHEMBL3503447 0.77 GLO1 (0.53) GLO1ACEMETAP2
SCHEMBL28671468 0.77 PPARA (0.61) GLO1ACEPPARGPPARA

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
CN-101701239-B Method for preparing glutathione by using hydantoinase method NANJING UNIVERSITY OF TECHNOLOGY 2011-08-31 — — CN disclosed
CN-101701239-A Method for preparing glutathione by using hydantoinase method NANJING UNIVERSITY OF TECHNOLOGY 2010-05-05 — — CN disclosed
Send feedback