SCHEMBL7414064

SCHEMBL7414064

CCCC(N(C(=N)N)C(=O)OCC)N(C)c1c(F)c(Oc2cccc(-c3nccn3C)c2)nc(Oc2cc(C#N)ccc2OCc2ccccc2)c1F

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F2 P00734 10/20 0.37
F10 P00742 10/20 0.37
F3 P13726 12/20 0.36
F7 P08709 3/20 0.34
PLG P00747 1/20 0.34
PLAU P00749 1/20 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
SCHEMBL7414066 0.86 F10 (0.40) F2F10F3PLGPLAU
SCHEMBL6596602 0.86 F2 (0.37) F2F10F3PLGPLAU
SCHEMBL6590932 0.85 F10 (0.35) F2F10F3F7PLG
SCHEMBL6590237 0.85 F2 (0.36) F2F10F3PLGPLAU
SCHEMBL6592182 0.85 F2 (0.37) F2F10F3F7
SCHEMBL6591343 0.84 FFAR1 (0.38) F2F10PLGPLAU
SCHEMBL6591208 0.81 PLG (0.36) F2F10F3PLGPLAU
SCHEMBL6596445 0.80 PLAU (0.34) F2F10F3PLGPLAU
SCHEMBL6592379 0.80 F2 (0.34) F2F10F3PLGPLAU
SCHEMBL6594348 0.80 ICMT (0.34) F2F10F3PLGPLAU

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
US-5994375-A ANTICOAGULANTS BERLEX LABORATORIES, INC. (US) 1999-11-30 US disclosed