SCHEMBL7303084

SCHEMBL7303084

CC(=O)SCC1(C(=O)NCC(=O)O)CCc2ccccc2C1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.57
MMP8 P22894 1/20 0.34
ACE P12821 1/20 0.33
PROC P04070 1/20 0.33

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
SCHEMBL7300905 0.91 MME (0.64) MMEMMP8PROC
SCHEMBL7294378 0.85 MME (0.56) MMEPROC
SCHEMBL7291761 0.84 MME (0.39) MMEACE
SCHEMBL7302752 0.83 ACE (0.38) MMEACE
SCHEMBL7294105 0.81 MME (0.82) MMEMMP8
SCHEMBL7295035 0.80 ERCC1 (0.46) MMP8
SCHEMBL7295024 0.77 KMT2A (0.48) MME
SCHEMBL7359978 0.76 MME (0.41) MMEMMP8ACE
SCHEMBL7294394 0.75 MME (0.63) MMEMMP8PROC
SCHEMBL7301481 0.75 TOP1 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0516980-B1 Novel 2-mercaptomethylene-tetrahydronaphthalene and indane-2-carboxamide derivatives as enkephalinase inhibitors MERRELL PHARMA INC (US) 1996-04-17 EP disclosed
US-5252601-A 2-mercaptomethylene-tetrahydronaphthalene and indane-2-carboxamide derivatives as enkephalinase inhibitors MERRELL DOW PHARMACEUTICALS INC. (US) 1993-10-12 US disclosed
EP-0516980-A1 Novel 2-mercaptomethylene-tetrahydronaphthalene and indane-2-carboxamide derivatives as enkephalinase inhibitors MERRELL PHARMACEUTICALS INC. (US) 1992-12-09 EP disclosed