SCHEMBL14159354

SCHEMBL14159354

CC1=C(C#N)C(=O)N(CCO)C(=O)C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ ALDH1A1 P00352 5/20 0.41
▸ MAPT P10636 5/20 0.41
▸ POLB P06746 2/20 0.41
▸ GAA P10253 2/20 0.41
▸ THRB P10828 2/20 0.41
▸ ALOX12 P18054 2/20 0.41
▸ PPARG P37231 2/20 0.41
▸ RECQL P46063 2/20 0.41
▸ BLM P54132 2/20 0.41
▸ MCL1 Q07820 2/20 0.41
▸ NCOA2 Q15596 2/20 0.41
▸ NCOA1 Q15788 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ USP2 O75604 1/20 0.35
▸ ALOX15 P16050 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
SCHEMBL2594812 0.88 KMT2A (0.40) MEN1KMT2AALDH1A1MAPTPOLB
SCHEMBL14694502 0.87 L3MBTL1 (0.35) MEN1KMT2AALDH1A1MAPTPOLB
SCHEMBL3875987 0.83 KDM4E (0.44) MEN1KMT2AALDH1A1MAPTPOLB
SCHEMBL13692648 0.81 SMN1; SMN2 (0.39) MEN1KMT2AALDH1A1MAPTGAA
SCHEMBL421735 0.81 KDM4E (0.40) MEN1KMT2AALDH1A1MAPTPOLB
SCHEMBL13931148 0.79 HTT (0.39) MEN1KMT2AALDH1A1GAAL3MBTL1
SCHEMBL14937623 0.77 GAA (0.43) MEN1KMT2AALDH1A1MAPTGAA
SCHEMBL10586818 0.77 KDM4E (0.37) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL10586024 0.76 KDM4E (0.39) ALDH1A1MAPTGAATHRBRECQL
SCHEMBL14714137 0.75 L3MBTL1 (0.37) MEN1KMT2AALDH1A1MAPTPOLB

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
EP-1664173-B1 METHOD FOR REDUCING THE ACETALDEHYDE LEVEL IN POLYESTERS EASTMAN CHEM CO (US) 2008-06-11 — — EP disclosed
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