SCHEMBL29879291

SCHEMBL29879291

O=C(Nc1cc(NCc2cn3cc(C4CC4)ccc3n2)ncn1)[C@H]1C[C@@H]1c1cc(Cl)ccn1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 18/20 0.41
▸ METTL3 Q86U44 1/20 0.38
▸ LRRK2 Q5S007 1/20 0.37

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
SCHEMBL29136804 1.00 KLKB1 (0.41) KLKB1METTL3LRRK2
SCHEMBL29879810 1.00 KLKB1 (0.41) KLKB1METTL3LRRK2
SCHEMBL29302926 1.00 KLKB1 (0.41) KLKB1METTL3LRRK2
SCHEMBL29136802 1.00 KLKB1 (0.41) KLKB1METTL3LRRK2
SCHEMBL29136908 1.00 KLKB1 (0.41) KLKB1METTL3LRRK2
SCHEMBL24737729 0.91 KLKB1 (0.41) KLKB1METTL3
SCHEMBL29136863 0.91 KLKB1 (0.41) KLKB1METTL3
SCHEMBL29137049 0.91 KLKB1 (0.41) KLKB1METTL3
SCHEMBL29136864 0.91 KLKB1 (0.41) KLKB1METTL3
SCHEMBL29879527 0.91 KLKB1 (0.41) KLKB1METTL3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4585265-A2 HETEROARYL INHIBITORS OF PLASMA KALLIKREIN Takeda Pharmaceutical Company Limited (JP) 2025-07-16 — — EP disclosed
EP-4308230-A1 HETEROARYL INHIBITORS OF PLASMA KALLIKREIN Takeda Pharmaceutical Company Limited (JP) 2024-01-24 — — EP disclosed
WO-2022197758-A1 HETEROARYL INHIBITORS OF PLASMA KALLIKREIN SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2022-09-22 — — WO disclosed
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