SCHEMBL7403726

SCHEMBL7403726

C=CCOC(=O)[C@H](CSCC)OC(=O)[C@H](C)CSC(C)=O

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TSHR P16473 1/20 0.31
MME P08473 1/20 0.30
ACE P12821 1/20 0.30

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
SCHEMBL7403724 1.00 TDP1 (0.31) TDP1SMN1; SMN2TSHRMMEACE
SCHEMBL7435219 0.86 TDP1 (0.33) TDP1MMEACE
SCHEMBL7435211 0.86 TDP1 (0.33) TDP1MMEACE
SCHEMBL7449289 0.83 TDP1 (0.31) TDP1
SCHEMBL9236292 0.83 TDP1 (0.33) TDP1TSHR
SCHEMBL9236293 0.83 TDP1 (0.33) TDP1TSHR
SCHEMBL7449297 0.83 TDP1 (0.31) TDP1
SCHEMBL7390843 0.83 TDP1 (0.31) TDP1
SCHEMBL7390844 0.83 TDP1 (0.31) TDP1
SCHEMBL7400849 0.82 TDP1 (0.33) TDP1MMEACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0535042-B1 ANGIOTENSIS CONVERTING ENZYME INHIBITORS FISONS PLC (GB) 1995-03-29 EP disclosed
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