SCHEMBL9023977

SCHEMBL9023977

CCCCCCN(CC(=O)Oc1ccccc1)C(=O)[C@@H](N)CS

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
FAAH O00519 6/20 0.37
MC4R P32245 2/20 0.37
MC5R P33032 2/20 0.37
MC3R P41968 2/20 0.37

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
SCHEMBL9024134 0.80 MC4R (0.40) PRSS1PRSS2PRSS3LMNAMC4R
SCHEMBL9021689 0.79 GRIK1 (0.36) MAPT
SCHEMBL9021692 0.79 GRIK1 (0.36) MAPT
SCHEMBL6235454 0.77 PTGS1 (0.37)
SCHEMBL29587699 0.76 FAAH (0.49) ZDHHC2FAAH
SCHEMBL29163485 0.76 FAAH (0.49) ZDHHC2FAAH
SCHEMBL28822992 0.76 FAAH (0.49) ZDHHC2FAAH
SCHEMBL29588120 0.76 FAAH (0.49) ZDHHC2FAAH
SCHEMBL29587784 0.75 FAAH (0.47) ZDHHC2FAAH
SCHEMBL6754891 0.73 MEN1 (0.51) LMNAMAPTZDHHC2FAAH

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-0720620-A1 GLUTATHIONE ANALOGS AND PARALOG PANELS COMPRISING GLUTATHIONE MIMICS TERRAPIN TECHNOLOGIES, INC. (US) 1996-07-10 EP disclosed
WO-1995008563-A1 GLUTATHIONE ANALOGS AND PARALOG PANELS COMPRISING GLUTATHIONE MIMICS TERRAPIN TECHNOLOGIES, INC. (US) 1995-03-30 WO disclosed