SCHEMBL20713746

SCHEMBL20713746

CNC(=O)CNC(=O)c1csc(C2CC(N)CN2C(=O)c2cn3cc(Cl)ccc3n2)n1

nearest known ligand 0.74

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 20/20 0.74

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
SCHEMBL22277080 0.86 KLKB1 (0.74) KLKB1
SCHEMBL22277217 0.86 KLKB1 (0.74) KLKB1
SCHEMBL20713648 0.86 KLKB1 (0.64) KLKB1
SCHEMBL20713763 0.86 KLKB1 (0.64) KLKB1
SCHEMBL20705180 0.85 KLKB1 (1.00) KLKB1
SCHEMBL22277305 0.84 KLKB1 (0.69) KLKB1
SCHEMBL20713766 0.84 KLKB1 (0.71) KLKB1
SCHEMBL31181741 0.84 KLKB1 (0.71) KLKB1
SCHEMBL20705247 0.84 KLKB1 (0.71) KLKB1
SCHEMBL20705259 0.84 KLKB1 (0.83) KLKB1

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-2019028362-A1 INHIBITORS OF PLASMA KALLIKREIN AND USES THEREOF DYAX CORP. (US) 2019-02-07 WO disclosed