SCHEMBL8445931

SCHEMBL8445931

Cn1cccc1[CH]c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.54
TRIM33 Q9UPN9 1/20 0.54
KMT2A Q03164 9/20 0.46
MEN1 O00255 7/20 0.46
MAPT P10636 8/20 0.42
ALDH1A1 P00352 6/20 0.42
GAA P10253 4/20 0.42
TDP1 Q9NUW8 4/20 0.42
KDM4E B2RXH2 4/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
GFER P55789 1/20 0.42
SMN1; SMN2 Q16637 6/20 0.42
RAB9A P51151 4/20 0.41
NPC1 O15118 3/20 0.41
USP2 O75604 3/20 0.41
TLR9 Q9NR96 2/20 0.41
NFKB1 P19838 2/20 0.41
NFKB2 Q00653 2/20 0.41
RELA Q04206 2/20 0.41
HPGD P15428 2/20 0.40

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
SCHEMBL2787808 0.81 TRIM24 (0.52) TRIM24TRIM33KMT2AMEN1MAPT
SCHEMBL2787807 0.81 TRIM24 (0.52) TRIM24TRIM33KMT2AMEN1MAPT
SCHEMBL12086582 0.81 TRIM24 (0.52) TRIM24TRIM33KMT2AMEN1MAPT
SCHEMBL15871031 0.74 TRIM24 (0.65) TRIM24TRIM33KMT2AMEN1MAPT
SCHEMBL16770286 0.70 TRIM24 (0.60) TRIM24TRIM33KMT2AMEN1MAPT
SCHEMBL2725558 0.70
SCHEMBL677899 0.70
SCHEMBL10445517 0.70
SCHEMBL16770285 0.70 TRIM24 (0.60) TRIM24TRIM33KMT2AMEN1MAPT
SCHEMBL260478 0.70

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-0942909-A1 BICYCLIC AMINE DERIVATIVES ZENECA LIMITED (GB) 1999-09-22 EP disclosed
WO-1998022463-A1 BICYCLIC AMINE DERIVATIVES ZENECA LIMITED (GB) 1998-05-28 WO disclosed