SCHEMBL24729615

SCHEMBL24729615

CC(OC(=O)Nc1cc(NCc2cn3cc(C4CC4)ccc3n2)ccn1)c1cc(Cl)ccc1-n1cnnn1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 18/20 0.37
▸ F11 P03951 1/20 0.35
▸ F2 P00734 1/20 0.35

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
SCHEMBL29926995 1.00 KLKB1 (0.37) KLKB1F11F2
SCHEMBL24729593 0.86 KLKB1 (0.39) KLKB1F2
SCHEMBL29958151 0.84 KLKB1 (0.39) KLKB1F11
SCHEMBL27033946 0.84 KLKB1 (0.39) KLKB1F11
SCHEMBL29957885 0.83 KLKB1 (0.39) KLKB1F11F2
SCHEMBL24729610 0.83 F2 (0.44) KLKB1F2
SCHEMBL27033656 0.83 KLKB1 (0.39) KLKB1F11F2
SCHEMBL24729494 0.83 KLKB1 (0.39) KLKB1
SCHEMBL24739069 0.82 KLKB1 (0.38) KLKB1F11F2
SCHEMBL24729591 0.77 KLKB1 (0.39) KLKB1F2

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-2022197755-A1 IMIDAZOPYRIDINYL INHIBITORS OF PLASMA KALLIKREIN SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2022-09-22 — — WO disclosed
Send feedback