SCHEMBL24845482

SCHEMBL24845482

CN(C)c1ccc(N=Nc2ccc(N=Nc3ccc(C=O)c(O)c3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.49
KMT2A Q03164 7/20 0.49
MEN1 O00255 6/20 0.49
RAB9A P51151 6/20 0.49
MAPT P10636 4/20 0.49
POLB P06746 4/20 0.49
MAPK1 P28482 3/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 6/20 0.48
TDP1 Q9NUW8 4/20 0.48
GAA P10253 2/20 0.48
THRB P10828 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
HTT P42858 1/20 0.48
CA12 O43570 2/20 0.48
CA2 P00918 2/20 0.48
CA9 Q16790 2/20 0.48
NSD2 O96028 1/20 0.47
CASP3 P42574 1/20 0.47
SENP8 Q96LD8 1/20 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
SCHEMBL1001895 0.81 TYR (0.52) KMT2AMEN1MAPTPOLBMAPK1
SCHEMBL29446225 0.81 TYR (0.52) KMT2AMEN1MAPTPOLBMAPK1
SCHEMBL11579558 0.80 MEN1 (0.55) NPC1KMT2AMEN1RAB9AMAPT
SCHEMBL15399461 0.80 MEN1 (0.55) NPC1KMT2AMEN1RAB9AMAPT
SCHEMBL13577823 0.78 PLCG1 (0.44) NPC1KMT2AMEN1RAB9AMAPT
SCHEMBL15941168 0.75 KMT2A (0.61) NPC1KMT2AMEN1RAB9AMAPT
SCHEMBL15941169 0.75 KMT2A (0.61) NPC1KMT2AMEN1RAB9AMAPT
SCHEMBL24849465 0.75 KMT2A (0.61) NPC1KMT2AMEN1RAB9AMAPT
SCHEMBL4401250 0.74 ERN1 (0.52) TRIM24TRIM33CYP2A6CYP2A13
SCHEMBL2098184 0.74 CYP2A6 (0.76) NPC1KMT2AMEN1RAB9AMAPT

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-2023276667-A1 COMPOUND, COMPOSITION, FILM, LAMINATE, AND DISPLAY DEVICE 住友化学株式会社 2023-01-05 WO disclosed