SCHEMBL30711722

SCHEMBL30711722

O=C(O)c1nccc(OCc2cn3cc(C4CC4)ccc3n2)n1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.41
▸ METTL3 Q86U44 1/20 0.41
▸ KLKB1 P03952 17/20 0.38
▸ KDM5A P29375 1/20 0.36
▸ KDM4C Q9H3R0 1/20 0.36
▸ KDM5B Q9UGL1 1/20 0.36

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
Formic Acid SCHEMBL30711633 0.96 METTL3 (0.39) KDM4EMETTL3KLKB1KDM5AKDM4C
SCHEMBL29957915 0.85 METTL3 (0.42) KDM4EMETTL3KLKB1
SCHEMBL27033572 0.85 METTL3 (0.42) KDM4EMETTL3KLKB1
Formic Acid SCHEMBL30711668 0.84 KLKB1 (0.36) KDM4EMETTL3KLKB1
SCHEMBL29957835 0.79 METTL3 (0.38) METTL3KLKB1
SCHEMBL27033584 0.78 METTL3 (0.41) METTL3KLKB1
SCHEMBL29958525 0.78 METTL3 (0.41) METTL3KLKB1
SCHEMBL29958329 0.77 SMN1; SMN2 (0.42) KDM4EMETTL3KLKB1
SCHEMBL29137034 0.76 METTL3 (0.47) METTL3KLKB1
SCHEMBL29141754 0.76 METTL3 (0.41) KDM4EMETTL3KLKB1

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
CN-117396474-A Plasma kallikrein inhibitors 武田药品工业株式会社 2024-01-12 — — CN disclosed
Send feedback