SCHEMBL8347518

SCHEMBL8347518

CCN(CC)c1ccc(CN[Co])c(O)c1.CCNC(=O)c1ccccc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.46
▸ MEN1 O00255 5/20 0.46
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ MAPT P10636 4/20 0.44
▸ NPC1 O15118 4/20 0.44
▸ LMNA P02545 3/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ TP53 P04637 1/20 0.44
▸ NFKB1 P19838 1/20 0.44
▸ NFKB2 Q00653 1/20 0.44
▸ RELA Q04206 1/20 0.44
▸ CA1 P00915 1/20 0.43
▸ CA9 Q16790 1/20 0.43
▸ KDM4E B2RXH2 4/20 0.41
▸ NAAA Q02083 1/20 0.41
▸ ESRRG P62508 1/20 0.40
▸ HTT P42858 3/20 0.38
▸ HPGD P15428 2/20 0.38
▸ ALOX12 P18054 2/20 0.38

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
SCHEMBL8347522 0.82 NAAA (0.46) KMT2AMEN1SMN1; SMN2L3MBTL1MAPT
SCHEMBL8343445 0.77 MAPT (0.53) KMT2AMEN1SMN1; SMN2L3MBTL1MAPT
SCHEMBL1797745 0.74 CA1 (0.68) KMT2AMEN1SMN1; SMN2L3MBTL1MAPT
SCHEMBL8343451 0.72 MAPT (0.52) KMT2AMEN1SMN1; SMN2L3MBTL1MAPT
SCHEMBL22938967 0.71 MEN1 (0.81) KMT2AMEN1SMN1; SMN2L3MBTL1MAPT
SCHEMBL8347809 0.71 CA1 (0.52) KMT2AMEN1SMN1; SMN2L3MBTL1MAPT
SCHEMBL8346501 0.70 HPGD (0.49) KMT2AMEN1SMN1; SMN2L3MBTL1MAPT
SCHEMBL7723758 0.70 CA1 (0.57) KMT2AMEN1SMN1; SMN2L3MBTL1MAPT
SCHEMBL18671198 0.69 SMN1; SMN2 (0.72) KMT2AMEN1SMN1; SMN2L3MBTL1MAPT
SCHEMBL537275 0.69 MEN1 (0.64) KMT2AMEN1SMN1; SMN2L3MBTL1MAPT

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-5969171-A Metal complexes as bleach activators CLARIANT GMBH (DE) 1999-10-19 — — US disclosed
Send feedback