SCHEMBL31218593

SCHEMBL31218593

CN(C)CCCNc1cccc2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.71
SMN1; SMN2 Q16637 4/20 0.71
MAPK1 P28482 4/20 0.71
MEN1 O00255 4/20 0.71
KMT2A Q03164 4/20 0.71
ALDH1A1 P00352 4/20 0.71
EGFR P00533 3/20 0.71
L3MBTL1 Q9Y468 3/20 0.71
RAD52 P43351 3/20 0.71
POLB P06746 2/20 0.71
HTT P42858 2/20 0.71
BLM P54132 2/20 0.71
LMNA P02545 2/20 0.71
RECQL P46063 1/20 0.71
NPSR1 Q6W5P4 1/20 0.71
BRCA1 P38398 1/20 0.63
HIF1A Q16665 1/20 0.63
NSD2 O96028 2/20 0.58
FGB P02675 1/20 0.58
MMP14 P50281 1/20 0.58

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
SCHEMBL3420790 0.96 SMN1; SMN2 (0.64) MAPTSMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL3853558 0.94 TERT (0.63) MAPTSMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL31218585 0.91 MAPT (0.63) MAPTSMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL3418752 0.91 MAPT (0.63) MAPTSMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL18984755 0.90 SMN1; SMN2 (0.67) MAPTSMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL30818304 0.90 SMN1; SMN2 (0.67) MAPTSMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL28844934 0.89 SMN1; SMN2 (0.58) MAPTSMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL13434544 0.87 SMN1; SMN2 (0.59) MAPTSMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL20333918 0.87 TERT (0.56) MAPTSMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL20334281 0.87 SMN1; SMN2 (0.55) MAPTSMN1; SMN2MAPK1MEN1KMT2A

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-4705394-A2 DISPERSE DYES FOR DYEING POLYESTER FIBRES University of Leeds (GB) 2026-03-11 EP disclosed
WO-2024228036-A2 DYE COMPOUNDS AND METHODS OF USING UNIVERSITY OF LEEDS (GB) 2024-11-07 WO disclosed