SCHEMBL8003697

SCHEMBL8003697

CCc1ccccc1-n1nnc(C(=O)Nc2cccc(Cl)c2)c1C

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
ALDH1A1 P00352 2/20 0.58
MEN1 O00255 1/20 0.58
LMNA P02545 1/20 0.58
MAPT P10636 1/20 0.58
HTT P42858 1/20 0.58
KMT2A Q03164 1/20 0.58
NR1I2 O75469 7/20 0.55
RAB9A P51151 3/20 0.50
TP53 P04637 2/20 0.50
RIPK1 Q13546 1/20 0.50
NPC1 O15118 2/20 0.49
HIF1A Q16665 1/20 0.48
SMURF1 Q9HCE7 1/20 0.48
POLB P06746 2/20 0.47

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
SCHEMBL3405064 0.89 MEN1 (0.60) SMN1; SMN2L3MBTL1ALDH1A1MEN1LMNA
SCHEMBL3407283 0.87 SMURF1 (0.59) SMN1; SMN2L3MBTL1ALDH1A1MEN1LMNA
SCHEMBL3403675 0.84 MAPT (0.78) SMN1; SMN2L3MBTL1ALDH1A1MEN1LMNA
SCHEMBL3404049 0.82 MAPT (0.55) SMN1; SMN2L3MBTL1ALDH1A1MEN1LMNA
SCHEMBL3406096 0.79 MAPT (0.62) SMN1; SMN2L3MBTL1ALDH1A1MEN1LMNA
SCHEMBL3407265 0.79 MAPT (0.65) SMN1; SMN2L3MBTL1ALDH1A1MEN1LMNA
SCHEMBL3403988 0.78 SMN1; SMN2 (0.64) SMN1; SMN2L3MBTL1ALDH1A1MEN1LMNA
SCHEMBL3407140 0.77 MAPT (0.60) SMN1; SMN2L3MBTL1ALDH1A1MEN1LMNA
SCHEMBL7986777 0.77 MEN1 (0.60) SMN1; SMN2L3MBTL1ALDH1A1MEN1LMNA
SCHEMBL3406689 0.77 MEN1 (0.62) SMN1; SMN2L3MBTL1ALDH1A1MEN1LMNA

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
WO-2009115486-A1 TRIAZOLE AMIDE DERIVATIVES FOR USE IN THERAPY GLAXO GROUP LIMITED (GB) 2009-09-24 WO disclosed