SCHEMBL6558211

SCHEMBL6558211

C[C@@H](C(=O)N1CCC[C@H]1CN1CCCC1)N1CC[C@H](N(Cl)S(=O)(=O)c2ccc(-c3cccs3)s2)C1=O

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 6/20 0.42
HRH3 Q9Y5N1 13/20 0.36
KCNH2 Q12809 2/20 0.34

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
SCHEMBL6559209 0.85 F10 (0.48) F10
SCHEMBL6625457 0.81 F10 (0.55) F10
SCHEMBL5143335 0.80 F10 (0.49) F10HRH3
SCHEMBL6558208 0.75 F10 (0.45) F10
SCHEMBL5142804 0.75 F10 (0.67) F10
SCHEMBL6558130 0.69 F10 (0.53) F10HRH3
SCHEMBL6558750 0.69 F10 (0.53) F10HRH3
SCHEMBL5143291 0.69 F10 (0.53) F10HRH3
SCHEMBL5143249 0.69 F10 (0.53) F10HRH3
SCHEMBL5143095 0.69 F10 (0.65) F10

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-1395606-A1 PYRROLIDIN-2-ONE DERIVATIVES AS INHIBITORS OF FACTOR XA GLAXO GROUP LIMITED (GB) 2004-03-10 EP disclosed
WO-2002100886-A1 PYRROLIDIN-2-ONE DERIVATIVES AS INHIBITORS OF FACTOR XA GLAXO GROUP LIMITED (GB) 2002-12-19 WO disclosed