SCHEMBL28085238

SCHEMBL28085238

CN(C)c1ccc2c3c(cccc13)C(=O)C2=O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.70
▸ MEN1 O00255 6/20 0.70
▸ POLB P06746 2/20 0.70
▸ USP2 O75604 4/20 0.62
▸ MAPT P10636 6/20 0.47
▸ KDM4E B2RXH2 4/20 0.47
▸ PABPC1 P11940 2/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ ALDH1A1 P00352 6/20 0.46
▸ TDP1 Q9NUW8 3/20 0.46
▸ LMNA P02545 2/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ NSD2 O96028 1/20 0.46
▸ EGFR P00533 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ CES1 P23141 2/20 0.43
▸ CES2 O00748 1/20 0.43
▸ BCHE P06276 1/20 0.43
▸ MCL1 Q07820 1/20 0.43
▸ CA2 P00918 1/20 0.43

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
SCHEMBL14255767 0.90 MAPT (0.63) KMT2AMEN1POLBUSP2MAPT
SCHEMBL30870383 0.85 MEN1 (0.66) KMT2AMEN1POLBUSP2MAPT
SCHEMBL3502868 0.85 MEN1 (0.66) KMT2AMEN1POLBUSP2MAPT
SCHEMBL12566469 0.84 MEN1 (0.64) KMT2AMEN1POLBUSP2MAPT
SCHEMBL30831694 0.84 MEN1 (0.69) KMT2AMEN1POLBUSP2MAPT
SCHEMBL3501337 0.84 MEN1 (0.69) KMT2AMEN1POLBUSP2MAPT
SCHEMBL11484431 0.82 KMT2A (1.00) KMT2AMEN1POLBUSP2MAPT
SCHEMBL2029464 0.81 KMT2A (0.74) KMT2AMEN1POLBUSP2MAPT
SCHEMBL19423810 0.81 KMT2A (0.74) KMT2AMEN1POLBUSP2MAPT
SCHEMBL24784337 0.79 KMT2A (0.70) KMT2AMEN1POLBUSP2MAPT

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-105837458-A A fluorescence probe, a preparing method thereof and applications of the fluorescence probe in peroxy acid detection 辽宁大学 2016-08-10 — — CN disclosed
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