SCHEMBL29649612

SCHEMBL29649612

CC(=O)c1cccc(OCCOCCOCCOCCOCCOCCN=[N+]=[N-])c1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 9/20 0.50
▸ MAOA P21397 3/20 0.49
▸ ABCG2 Q9UNQ0 4/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ LMNA P02545 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ ABCB1 P08183 1/20 0.44

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
SCHEMBL25362791 1.00 MAOB (0.50) MAOBMAOAABCG2KMT2AMEN1
SCHEMBL14270131 0.92 MAOB (0.55) MAOBMAOAKMT2AMEN1ALDH1A1
SCHEMBL13554747 0.88 KMT2A (0.56) ABCG2KMT2A
SCHEMBL20682706 0.88 KMT2A (0.56) ABCG2KMT2A
SCHEMBL13554687 0.88 KMT2A (0.56) ABCG2KMT2A
SCHEMBL13554738 0.88 ABCG2 (0.55) ABCG2KMT2AMEN1MAPTALDH1A1
SCHEMBL14649336 0.88 ABCG2 (0.55) ABCG2KMT2AMEN1MAPTALDH1A1
SCHEMBL24395286 0.84 L3MBTL1 (0.57) MAOBABCG2LMNAMAPTALDH1A1
SCHEMBL24395275 0.84 L3MBTL1 (0.57) MAOBABCG2LMNAMAPTALDH1A1
SCHEMBL5974513 0.82 MAOB (0.68) MAOBMAOAKMT2AMEN1ALDH1A1

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
EP-4237008-A2 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF Elucida Oncology, Inc. (US) 2023-09-06 — — EP disclosed
WO-2022093800-A2 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF ELUCIDA ONCOLOGY, INC. (US) 2022-05-05 — — WO disclosed
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