SCHEMBL7294452

SCHEMBL7294452

O=C(O)CCNC(=O)C1(CS)CCc2ccccc2C1

nearest known ligand 0.82

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.61
HTR2A P28223 2/20 0.40
HRH1 P35367 2/20 0.40
HTR2C P28335 1/20 0.40
KCNH2 Q12809 1/20 0.40
ACE P12821 1/20 0.39

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
SCHEMBL7320924 0.90 MME (0.56) MMEHTR2C
SCHEMBL7293970 0.90 MME (0.56) MMEHTR2C
SCHEMBL7294105 0.87 MME (0.82) MME
SCHEMBL7303622 0.81 MME (0.43) MMEHTR2AHRH1HTR2CKCNH2
SCHEMBL7292661 0.80 MME (0.55) MME
SCHEMBL7301621 0.76 MME (1.00) MMEACE
SCHEMBL7294573 0.76 MME (0.57) MME
SCHEMBL7294567 0.76 MME (0.57) MME
SCHEMBL7291958 0.76 ERCC1 (0.50) MME
SCHEMBL7293268 0.74 MME (0.48) MME

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