SCHEMBL24729469

SCHEMBL24729469

O=C(Nc1cc(NCc2cn3cc(C4CC4)ccc3n2)ccn1)OCc1cccc(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 11/20 0.40
▸ DGAT1 O75907 1/20 0.40
▸ METTL3 Q86U44 2/20 0.39
▸ BRAF P15056 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ FSHR P23945 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ RAB9A P51151 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
SCHEMBL24729482 0.89 KLKB1 (0.40) KLKB1DGAT1METTL3TSHRFSHR
SCHEMBL29927020 0.89 KLKB1 (0.40) KLKB1DGAT1METTL3TSHRFSHR
SCHEMBL24729494 0.84 KLKB1 (0.39) KLKB1DGAT1METTL3BRAF
SCHEMBL24729593 0.82 KLKB1 (0.39) KLKB1
SCHEMBL29879153 0.82 DGAT1 (0.42) KLKB1DGAT1METTL3BRAF
SCHEMBL29136815 0.82 DGAT1 (0.42) KLKB1DGAT1METTL3BRAF
SCHEMBL29136754 0.82 DGAT1 (0.42) KLKB1DGAT1METTL3BRAF
SCHEMBL24739072 0.82 DGAT1 (0.42) KLKB1DGAT1METTL3BRAF
SCHEMBL29136756 0.82 DGAT1 (0.42) KLKB1DGAT1METTL3BRAF
SCHEMBL27957767 0.82 DGAT1 (0.42) KLKB1DGAT1METTL3BRAF

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-4308227-A1 IMIDAZOPYRIDINYL INHIBITORS OF PLASMA KALLIKREIN Takeda Pharmaceutical Company Limited (JP) 2024-01-24 — — EP disclosed
WO-2022197755-A1 IMIDAZOPYRIDINYL INHIBITORS OF PLASMA KALLIKREIN SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2022-09-22 — — WO disclosed
WO-2022197755-A1 IMIDAZOPYRIDINYL INHIBITORS OF PLASMA KALLIKREIN SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2022-09-22 — — WO disclosed
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