SCHEMBL8428964

SCHEMBL8428964

Cc1cc(C)cc(-c2c(C(C)C)c(=O)n([Se])c(=O)n2CCCc2ccccc2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.38
LMNA P02545 3/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
ADORA3 P0DMS8 2/20 0.37
ALDH1A1 P00352 2/20 0.37
GAA P10253 1/20 0.37
G6PD P11413 1/20 0.37
ADORA2B P29275 1/20 0.37
CSNK2A2 P19784 1/20 0.36
CSNK2B P67870 1/20 0.36
CSNK2A1 P68400 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
USP2 O75604 1/20 0.35
POLB P06746 2/20 0.35
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
TSSK1B Q9BXA7 1/20 0.35
GSK3A P49840 1/20 0.35
GSK3B P49841 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
SCHEMBL8430882 0.83 L3MBTL1 (0.41) L3MBTL1LMNAMEN1KMT2AADORA3
SCHEMBL8430943 0.81 ALDH1A1 (0.39) LMNAALDH1A1
SCHEMBL8430679 0.73
SCHEMBL8430883 0.70 HTT (0.35) MAPT
SCHEMBL8428965 0.67 MEN1 (0.43) L3MBTL1LMNAMEN1KMT2AALDH1A1
SCHEMBL8426833 0.65 ALDH1A1 (0.36) LMNAMEN1KMT2AALDH1A1GAA
SCHEMBL8428896 0.64 ALDH1A1 (0.42) ALDH1A1POLBMAPTNPSR1
SCHEMBL7540908 0.61 MEN1 (0.53) LMNAMEN1KMT2AALDH1A1USP2
SCHEMBL8426925 0.60 MEN1 (0.48) LMNAMEN1KMT2AALDH1A1GAA
SCHEMBL2351932 0.60 NOS3 (0.56) L3MBTL1MEN1KMT2APOLBKDM4E

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
US-5889013-A REACTING AN URACIL COMPOUND WITH N, O-BIS/TRIMETHYLSILYL/ACETAMIDE FOLLOWED BY TETRABUTYLAMMONIUM IODIDE AND CHLOROMETHYL ETHER COMPOUND AND THEN REACTING WITH ARYL SELENOL IN A BASE SUNKYONG INDUSTRIES CO., INC. (KR) 1999-03-30 US disclosed