SCHEMBL29957835

SCHEMBL29957835

c1cc(OCc2cn3cc(C4CC4)ccc3n2)ncn1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 1/20 0.38
▸ RXRA P19793 2/20 0.36
▸ GRIN1 Q05586 2/20 0.36
▸ GRIN2B Q13224 2/20 0.36
▸ KLKB1 P03952 16/20 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
SCHEMBL29958329 0.84 SMN1; SMN2 (0.42) METTL3KLKB1
SCHEMBL29957846 0.81 METTL3 (0.41) METTL3KLKB1
SCHEMBL27033446 0.81 METTL3 (0.41) METTL3KLKB1
SCHEMBL24738257 0.81 METTL3 (0.39) METTL3KLKB1
SCHEMBL30711722 0.79 KDM4E (0.41) METTL3KLKB1
SCHEMBL29880148 0.78 KLKB1 (0.39) METTL3KLKB1
SCHEMBL24739315 0.78 KLKB1 (0.39) METTL3KLKB1
SCHEMBL30997765 0.78 METTL3 (0.43) METTL3KLKB1
SCHEMBL30997865 0.76 KLKB1 (0.39) METTL3KLKB1
SCHEMBL29303099 0.76 KLKB1 (0.39) METTL3KLKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4308228-A1 PLASMA KALLIKREIN INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2024-01-24 — — EP disclosed
WO-2022197756-A1 PLASMA KALLIKREIN INHIBITORS SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2022-09-22 — — WO disclosed
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