SCHEMBL31254097

SCHEMBL31254097

COC(=O)CCNc1nn(C)c2c([N+](=O)[O-])cccc12

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.52
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ KAT2B Q92831 4/20 0.37
▸ MAPT P10636 3/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ HPGD P15428 1/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ TXNRD1 Q16881 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ GSTP1 P09211 1/20 0.36
▸ GSTM2 P28161 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 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
SCHEMBL28984087 1.00 LMNA (0.52) LMNAL3MBTL1KAT2BMAPTALDH1A1
SCHEMBL28984105 0.89 ALDH1A1 (0.49) LMNAL3MBTL1MAPTALDH1A1HPGD
SCHEMBL30472894 0.89 ALDH1A1 (0.49) LMNAL3MBTL1MAPTALDH1A1HPGD
SCHEMBL28984095 0.76 ALDH1A1 (0.40) LMNAL3MBTL1MAPTALDH1A1MEN1
SCHEMBL30955765 0.76 LMNA (0.44) LMNAL3MBTL1MAPTALDH1A1MEN1
SCHEMBL13728477 0.72 MAPT (0.58) LMNAL3MBTL1KAT2BMAPTALDH1A1
SCHEMBL31554609 0.71 ALDH1A1 (0.46) LMNAL3MBTL1MAPTALDH1A1MEN1
SCHEMBL31237400 0.70 CHRM2 (0.66) LMNAMAPTALDH1A1HPGDMEN1
SCHEMBL1346463 0.70 LMNA (0.50) LMNAMAPTALDH1A1HPGDMEN1
SCHEMBL13106231 0.70 TDP1 (0.48) L3MBTL1MAPTALDH1A1POLBTDP1

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-119306706-A Difunctional compound targeting androgen receptor protein degradation and application thereof 上海壹迪生物技术有限公司 2025-01-14 — — CN disclosed
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