SCHEMBL7449297

SCHEMBL7449297

C=CCOC(=O)[C@H](CC#N)OC(=O)[C@H](C)CSC(C)=O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL7449289 1.00 TDP1 (0.31) TDP1
SCHEMBL7435219 0.85 TDP1 (0.33) TDP1
SCHEMBL7435211 0.85 TDP1 (0.33) TDP1
SCHEMBL7403726 0.83 TDP1 (0.31) TDP1
SCHEMBL7403724 0.83 TDP1 (0.31) TDP1
SCHEMBL9236292 0.82 TDP1 (0.33) TDP1
SCHEMBL9236293 0.82 TDP1 (0.33) TDP1
SCHEMBL7390843 0.82 TDP1 (0.31) TDP1
SCHEMBL7390844 0.82 TDP1 (0.31) TDP1
SCHEMBL7400849 0.81 TDP1 (0.33) TDP1

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
US-5348978-A Angiotensin converting enzyme inhibitors FISONS PLC (GB) 1994-09-20 US disclosed
EP-0535042-A1 ANGIOTENSIS CONVERTING ENZYME INHIBITORS. FISONS PLC (GB) 1993-04-07 EP disclosed
WO-1992000276-A2 ANGIOTENSIS CONVERTING ENZYME INHIBITORS FISONS PLC (GB) 1992-01-09 WO disclosed