SCHEMBL7993267

SCHEMBL7993267

O=C(NC[C@H]1CN(c2ccc(C3=NCCN4C(=O)CCN34)cc2)C(=O)O1)C1CC=C(Cl)S1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.44
ABCB11 O95342 1/20 0.43
F2 P00734 1/20 0.43
ST14 Q9Y5Y6 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
SCHEMBL7983040 0.88 F10 (0.44) F10ABCB11F2ST14
SCHEMBL4761192 0.83 F10 (0.66) F10ABCB11F2ST14
SCHEMBL7984854 0.82 F10 (0.41) F10ABCB11F2ST14
SCHEMBL7997062 0.82 F10 (0.44) F10ABCB11F2ST14
SCHEMBL7992783 0.81 F10 (0.43) F10ABCB11F2ST14
SCHEMBL7983045 0.80 F10 (0.44) F10
SCHEMBL7995874 0.79 F10 (0.44) F10ABCB11F2ST14
SCHEMBL7982750 0.79 F10 (0.66) F10ABCB11F2ST14
SCHEMBL8000437 0.79 F10 (0.47) F10ABCB11F2ST14
SCHEMBL7982207 0.78 F10 (0.42) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010002115-A2 FXA INHIBITORS WITH CYCLIC AMIDOXIME OR CYCLIC AMIDRAZONE AS P4 SUBUNIT, PROCESSES FOR THEIR PREPARATIONS, AND PHARMACEUTICAL COMPOSITIONS AND DERIVATIVES THEREOF LEGOCHEM BIOSCIENCE LTD. (KR) 2010-01-07 WO disclosed