SCHEMBL22299607

SCHEMBL22299607

CCN(CC)c1ccc(/C=N/c2ccc(/N=N/c3ccc(/N=N/c4nccs4)cc3)c3ccccc23)c(O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.52
MAPT P10636 14/20 0.51
ALDH1A1 P00352 12/20 0.51
KDM4E B2RXH2 8/20 0.51
RAB9A P51151 3/20 0.51
NPC1 O15118 2/20 0.51
MEN1 O00255 7/20 0.50
LMNA P02545 6/20 0.50
TDP1 Q9NUW8 4/20 0.50
CRHBP P24387 1/20 0.50
CRHR2 Q13324 1/20 0.50
GAA P10253 5/20 0.48
HTT P42858 5/20 0.48
NPSR1 Q6W5P4 2/20 0.48
THRB P10828 1/20 0.48
SMN1; SMN2 Q16637 6/20 0.46
MAPK1 P28482 3/20 0.45
BLM P54132 1/20 0.45
HPGD P15428 4/20 0.45
USP2 O75604 1/20 0.45

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
SCHEMBL22299812 0.94 MAPT (0.52) KMT2AMAPTALDH1A1KDM4ERAB9A
SCHEMBL22299856 0.83 MAPT (0.46) KMT2AMAPTALDH1A1KDM4ERAB9A
SCHEMBL4778752 0.79 MAPT (0.63) KMT2AMAPTALDH1A1KDM4ERAB9A
SCHEMBL4778757 0.79 MAPT (0.63) KMT2AMAPTALDH1A1KDM4ERAB9A
SCHEMBL22299217 0.78 MAPT (0.54) KMT2AMAPTALDH1A1KDM4ERAB9A
SCHEMBL22299218 0.75 MAPT (0.65) KMT2AMAPTALDH1A1KDM4ERAB9A
SCHEMBL18440445 0.74 KMT2A (0.68) KMT2AMAPTALDH1A1KDM4ERAB9A
SCHEMBL22193008 0.74 KMT2A (0.68) KMT2AMAPTALDH1A1KDM4ERAB9A
SCHEMBL18440444 0.74 KMT2A (0.68) KMT2AMAPTALDH1A1KDM4ERAB9A
SCHEMBL2927483 0.74 MAPT (0.51) KMT2AMAPTALDH1A1KDM4ERAB9A

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-2020156832-A1 DICHROIC AZO-AZOMETHINE DYES FOR LIQUID CRYSTAL COMPOSITIONS BASF SE (DE) 2020-08-06 WO disclosed