SCHEMBL4757953

SCHEMBL4757953

CCC(C)C(C(=O)N1CCOCC1)N1CCC(NS(=O)(=O)CC(=O)c2ccc(Cl)cc2)C1=O

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.53
F2 P00734 3/20 0.52
KLKB1 P03952 3/20 0.52
PLAT P00750 1/20 0.45

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
SCHEMBL4705477 1.00 F10 (0.53) F10F2KLKB1PLAT
SCHEMBL4758892 0.86 F10 (0.53) F10F2KLKB1PLAT
SCHEMBL4705527 0.86 F10 (0.53) F10F2KLKB1PLAT
SCHEMBL4702691 0.86 F10 (0.53) F10F2KLKB1PLAT
SCHEMBL4704105 0.85 F10 (0.53) F10F2KLKB1PLAT
SCHEMBL4704284 0.85 F10 (0.57) F10F2KLKB1PLAT
SCHEMBL4704286 0.85 F10 (0.57) F10F2KLKB1PLAT
SCHEMBL4756206 0.84 F10 (0.51) F10F2KLKB1PLAT
SCHEMBL4704241 0.82 F10 (0.56) F10F2KLKB1
SCHEMBL4701981 0.80 F10 (0.51) F10F2KLKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1567489-B1 PYRROLIDIN-2-ONE DERIVATIVES AS INHIBITORS OF THROMBIN AND FACTOR XA GLAXO GROUP LTD (GB) 2008-07-23 EP disclosed