SCHEMBL7995874

SCHEMBL7995874

CN1CCON=C1c1ccc(N2C[C@H](CNC(=O)C3CC=C(Cl)S3)OC2=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.44
ABCB11 O95342 1/20 0.42
F2 P00734 1/20 0.42
ST14 Q9Y5Y6 1/20 0.42

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
SCHEMBL7983045 0.88 F10 (0.44) F10
SCHEMBL7983038 0.87 F10 (0.48) F10ABCB11F2ST14
SCHEMBL8001812 0.85 F10 (0.47) F10ABCB11F2ST14
SCHEMBL7983945 0.83 F10 (0.43) F10ABCB11F2ST14
SCHEMBL7982207 0.83 F10 (0.42) F10
SCHEMBL4285179 0.82 F10 (0.68) F10ABCB11F2ST14
SCHEMBL7988853 0.82 F10 (0.49) F10ABCB11F2ST14
SCHEMBL7992783 0.81 F10 (0.43) F10ABCB11F2ST14
SCHEMBL7994083 0.80 F10 (0.45) F10ABCB11F2ST14
SCHEMBL7997701 0.80 F10 (0.45) F10ABCB11F2ST14

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