SCHEMBL31529228

SCHEMBL31529228

C[C@@H]1O[C@H](Nc2nccc3[nH]cnc23)[C@H](O)[C@H](O)[C@H]1NC(=O)CN(C)C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PAX8 Q06710 1/20 0.39
▸ BUB1 O43683 1/20 0.30

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
SCHEMBL31529295 0.82 PAX8 (0.44) PAX8BUB1
SCHEMBL31529142 0.82 PAX8 (0.47) PAX8
SCHEMBL31529129 0.80 PAX8 (0.41) PAX8
SCHEMBL31529080 0.79 PAX8 (0.34) PAX8BUB1
SCHEMBL31529204 0.79 PAX8 (0.44) PAX8
SCHEMBL31529343 0.79 PAX8 (0.34) PAX8BUB1
SCHEMBL31529131 0.78 PAX8 (0.38) PAX8
SCHEMBL31529121 0.72 PAX8 (0.48) PAX8
SCHEMBL31529155 0.71 ADORA1 (0.43) —
SCHEMBL31529217 0.67 PAX8 (0.30) PAX8

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
WO-2025090774-A1 CHEMOTHERAPEUTIC COMPOUNDS AND METHODS OF USE SEAGEN INC. (US) 2025-05-01 — — WO disclosed
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