SCHEMBL8548180

SCHEMBL8548180

CC(C)(C)OC(=O)NCC(C(=O)N1CCCCC1)C(NS(=O)(=O)c1ccc2ccccc2c1)C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 3/20 0.49
PLG P00747 2/20 0.49
PLAU P00749 2/20 0.49
ACACB O00763 1/20 0.49
F2 P00734 5/20 0.46
HPN P05981 1/20 0.43

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
SCHEMBL8544739 0.92 PLAU (0.47) F10PLGPLAUACACBF2
SCHEMBL6787163 0.86 F10 (0.55) F10PLGPLAUACACBF2
SCHEMBL6794066 0.79 ACACB (0.54) F10PLGPLAUACACBF2
SCHEMBL7304701 0.77 F10 (0.56) F10PLGPLAUF2HPN
SCHEMBL6792561 0.74 ACACB (0.52) F10PLGPLAUACACBF2
SCHEMBL8546892 0.74 ACACB (0.55) F10PLGACACBF2HPN
SCHEMBL7407648 0.72 ACACB (0.49) F10PLGPLAUACACBF2
SCHEMBL27489065 0.72 PLG (0.67) F10PLGPLAUF2
Hydrochloric Acid SCHEMBL7708401 0.71 F2 (0.55) F10PLGPLAUF2
Hydrochloric Acid SCHEMBL6793275 0.71 PLG (0.66) F10PLGPLAUF2

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-0783500-B1 AMINOHETEROCYCLIC DERIVATIVES AS ANTITHROMBOTIC OR ANTICOAGULANT AGENTS ZENECA LTD (GB) 1998-07-22 EP disclosed