SCHEMBL31434479

SCHEMBL31434479

C#CCN1CCN(C(=O)CO[Si](C)(C)C(C)(C)C)CC1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ PKM P14618 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ GAA P10253 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL31434587 0.78 MEN1 (0.40) BCHEL3MBTL1ALDH1A1GAAKMT2A
SCHEMBL18836680 0.76 L3MBTL1 (0.58) L3MBTL1ALDH1A1KMT2A
SCHEMBL12161038 0.74 BCHE (0.36) BCHEPKMALDH1A1GAA
SCHEMBL27482144 0.72 BLM (0.42) BCHEPKMALDH1A1KMT2A
SCHEMBL14455057 0.72 HSD11B1 (0.41) BCHEALDH1A1KMT2A
SCHEMBL113614 0.71 USP2 (0.54) L3MBTL1ALDH1A1KMT2A
SCHEMBL31434405 0.70 MAPT (0.39) BCHEALDH1A1KMT2A
SCHEMBL928074 0.69 CYP2D6 (0.42) BCHEL3MBTL1PKMALDH1A1KMT2A
SCHEMBL31434503 0.69 ALDH1A1 (0.55) ALDH1A1KMT2A
SCHEMBL299361 0.68 PIK3CD (0.52) BCHEL3MBTL1ALDH1A1KMT2A

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-2025051241-A1 MACROCYCLIC COMPOUND AND ANTIBODY-DRUG CONJUGATE THEREOF 劲方医药科技(上海)股份有限公司 2025-03-13 — — WO disclosed
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