SCHEMBL20649339

SCHEMBL20649339

O=c1ccn(-c2ccc(O)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.59
HSP90AA1 P07900 1/20 0.52
PKM P14618 1/20 0.52
MAPK1 P28482 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
MGLL Q99685 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
ENPP2 Q13822 1/20 0.47
MKNK1 Q9BUB5 1/20 0.47
MKNK2 Q9HBH9 1/20 0.47
POLB P06746 2/20 0.42
APAF1 O14727 1/20 0.42
ESR1 P03372 4/20 0.39
ESR2 Q92731 4/20 0.39
COMT P21964 1/20 0.39
KDM4E B2RXH2 3/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL599252 0.77 VHL (0.56) KMT2AMAPK1NPSR1ENPP2MKNK1
SCHEMBL78611 0.76 KMT2A (0.53) KMT2AMAPK1NPSR1MGLLTDP1
SCHEMBL11625350 0.76 KMT2A (0.53) KMT2ANPSR1MGLLPOLBMEN1
SCHEMBL92862 0.76 KMT2A (0.59) KMT2AMGLLTDP1POLBKDM4E
SCHEMBL7316169 0.76 KMT2A (0.69) KMT2ANPSR1TDP1POLBKDM4E
SCHEMBL7319404 0.75 KMT2A (0.52) KMT2AHSP90AA1PKMMAPK1MGLL
SCHEMBL1377974 0.74 KMT2A (0.67) KMT2ATDP1POLBALDH1A1MAPT
SCHEMBL334849 0.74 KMT2A (1.00) KMT2AMEN1ALDH1A1MAPTNPC1
SCHEMBL7348821 0.74 KMT2A (0.67) KMT2ATDP1POLBMEN1ALDH1A1
SCHEMBL10472772 0.71 BCHE (0.52) KMT2ANPSR1POLBKDM4EMEN1

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-2019012963-A1 CYANINE COMPOUND AND FLUORESCENT DYE USING SAME 国立大学法人名古屋大学 2019-01-17 WO disclosed