SCHEMBL29137034

SCHEMBL29137034

NC(=O)OCc1cn2cc(C3CC3)ccc2n1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 1/20 0.47
KLKB1 P03952 17/20 0.42
TSHR P16473 1/20 0.42
PKM P14618 1/20 0.39
BLM P54132 1/20 0.39

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
SCHEMBL21355420 0.84 METTL3 (0.48) METTL3KLKB1
SCHEMBL21355335 0.80 KDM4E (0.51) METTL3KLKB1
SCHEMBL29141754 0.80 METTL3 (0.41) METTL3KLKB1
SCHEMBL21355035 0.79 METTL3 (0.47) METTL3KLKB1
SCHEMBL21368346 0.79 METTL3 (0.45) METTL3KLKB1
SCHEMBL21354790 0.79 METTL3 (0.45) METTL3KLKB1
SCHEMBL21355379 0.78 METTL3 (0.43) METTL3KLKB1
SCHEMBL29958525 0.78 METTL3 (0.41) METTL3KLKB1
SCHEMBL27033584 0.78 METTL3 (0.41) METTL3KLKB1
SCHEMBL21355039 0.78 METTL3 (0.48) 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
CN-117355521-A Heteroaryl inhibitors of plasma kallikrein 武田药品工业株式会社 2024-01-05 CN disclosed
CN-117355523-A Polycyclic inhibitors of plasma kallikrein 武田药品工业株式会社 2024-01-05 CN disclosed