SCHEMBL9236292

SCHEMBL9236292

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

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.33
TSHR P16473 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
SCHEMBL9236293 1.00 TDP1 (0.33) TDP1TSHR
SCHEMBL7400850 0.91 TDP1 (0.33) TDP1
SCHEMBL7400849 0.91 TDP1 (0.33) TDP1
SCHEMBL7390844 0.87 TDP1 (0.31) TDP1
SCHEMBL7390843 0.87 TDP1 (0.31) TDP1
SCHEMBL7435211 0.85 TDP1 (0.33) TDP1
SCHEMBL7435219 0.85 TDP1 (0.33) TDP1
SCHEMBL7403726 0.83 TDP1 (0.31) TDP1TSHR
SCHEMBL7403724 0.83 TDP1 (0.31) TDP1TSHR
SCHEMBL7401069 0.82 MME (0.35)

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 2 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