SCHEMBL7311485

SCHEMBL7311485

CCCCCCC[C@@H]1C[C@H](CSC(C)=O)OC1=O

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.71
SMN1; SMN2 Q16637 1/20 0.71
KMT2A Q03164 2/20 0.63
MEN1 O00255 1/20 0.63
LMNA P02545 1/20 0.55
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 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
SCHEMBL7317058 1.00 HTT (0.71) HTTSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL7440275 1.00 HTT (0.71) HTTSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL3658650 0.81 HTT (0.62) HTTSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL9673119 0.80 HTT (0.61) HTTSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL9673101 0.80 HTT (0.61) HTTSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL9673095 0.80 HTT (0.61) HTTSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL9450606 0.79 HTT (0.60) HTTSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL3657694 0.79 HTT (0.59) HTTSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL10543134 0.78 HTT (0.58) HTTSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL9450633 0.78 HTT (0.58) HTTSMN1; SMN2KMT2AMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0818443-B1 Mercaptoketones and mercaptoalcohols, a process for their preparation and their use as inhibitors of matrix metalloproteinases AMERICAN CYANAMID CO (US) 2001-12-05 EP disclosed
US-6160132-A Mercaptoketones and mercaptoalcohols and a process for their preparation AMERICAN CYANAMID COMPANY (US) 2000-12-12 US disclosed
US-6124502-A Mercaptoketones and mercaptoalcohols and a process for their preparation AMERICAN CYANAMID COMPANY (US) 2000-09-26 US disclosed
US-5852213-A Mercaptoketones and mercaptoalcohols and a process for their preparation AMERICAN CYANAMID COMPANY (US) 1998-12-22 US disclosed
EP-0818443-A2 Mercaptoketones and mercaptoalcohols, a process for their preparation and their use as inhibitors of matrix metalloproteinases American Cyanamid Company (US) 1998-01-14 EP disclosed