SCHEMBL5296971

SCHEMBL5296971

COC(=O)[C@H]1CN(S(=O)(=O)/C=C/c2ccc(Cl)s2)CC(=O)N1C(c1ccc(=O)n(C)n1)C1CCNCC1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 3/20 0.32
F2 P00734 1/20 0.32
KLKB1 P03952 1/20 0.32

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
SCHEMBL4932671 1.00 F10 (0.32) F10F2KLKB1
SCHEMBL4939759 0.92 F10 (0.33) F10F2KLKB1
SCHEMBL4939375 0.78 F10 (0.39) F10F2
SCHEMBL4938570 0.77 F10 (0.48) F10
SCHEMBL4881821 0.76 ALDH1A1 (0.33) F10
SCHEMBL5434287 0.75 F10 (0.38) F10F2KLKB1
SCHEMBL4932668 0.75 F10 (0.38) F10F2KLKB1
SCHEMBL4932657 0.75 F10 (0.38) F10F2KLKB1
SCHEMBL4934903 0.73 PPARG (0.34) F10
SCHEMBL4888127 0.73 HTR6 (0.36)

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-2007008143-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVES AS INHIBITORS OF FACTOR XA ASTRAZENECA AB (SE) 2007-01-18 WO disclosed