SCHEMBL3634639

SCHEMBL3634639

CC[C@H](NC(=O)/C=C/c1cc(Cl)ccc1-c1nnn[nH]1)C(=O)Nc1ccc(NC(=O)OC)cc1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F11 P03951 19/20 0.51
KLKB1 P03952 10/20 0.51
F10 P00742 2/20 0.41
PLG P00747 2/20 0.41
PLAT P00750 1/20 0.41
F9 P00740 1/20 0.41
MMP2 P08253 1/20 0.41
PROC P04070 1/20 0.40

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
SCHEMBL3633421 0.90 F11 (0.65) F11KLKB1F10PLGPLAT
SCHEMBL3633162 0.89 F11 (0.46) F11KLKB1F10PLGPLAT
SCHEMBL3633067 0.85 F11 (0.52) F11KLKB1
SCHEMBL3630833 0.84 F11 (0.57) F11KLKB1F10PLGPLAT
SCHEMBL3632133 0.82 F11 (0.58) F11KLKB1F10PLGPLAT
SCHEMBL3634839 0.80 F11 (0.54) F11KLKB1F10PLGPLAT
SCHEMBL3634248 0.80 F11 (0.57) F11KLKB1
SCHEMBL3634272 0.79 F11 (0.51) F11KLKB1
SCHEMBL3635449 0.79 F11 (0.57) F11KLKB1
SCHEMBL3633059 0.79 F11 (0.48) F11KLKB1

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-2152664-A1 DIPEPTIDE ANALOGS AS COAGULATION FACTOR INHIBITORS Brystol-Myers Squibb Company (US) 2010-02-17 EP disclosed
WO-2008157162-A1 DIPEPTIDE ANALOGS AS COAGULATION FACTOR INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-12-24 WO disclosed