SCHEMBL18159945

SCHEMBL18159945

Nc1ccc(/N=N/c2ccc(N)c(C(=O)O)c2)cc1OC=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.45
MEN1 O00255 4/20 0.45
PDE4A P27815 1/20 0.45
BLVRB P30043 1/20 0.45
KDR P35968 1/20 0.45
HTT P42858 1/20 0.45
KDM4E B2RXH2 2/20 0.44
GFER P55789 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
TDP1 Q9NUW8 3/20 0.42
THRB P10828 2/20 0.42
RECQL P46063 2/20 0.42
BLM P54132 2/20 0.42
MAPT P10636 2/20 0.42
MCL1 Q07820 2/20 0.42
USP2 O75604 1/20 0.42
POLB P06746 1/20 0.42
PKM P14618 1/20 0.42
APEX1 P27695 1/20 0.42
GLA P06280 1/20 0.41

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
SCHEMBL18162857 0.83 KMT2A (0.62) KMT2AMEN1PDE4ABLVRBKDR
SCHEMBL15293570 0.81 KMT2A (0.66) KMT2AMEN1KDM4EGFERRXFP1
SCHEMBL12775042 0.77 ALDH1A1 (0.69) KMT2AMEN1KDM4EGFERRXFP1
SCHEMBL1708800 0.75 IDO1 (0.43) KMT2AMEN1KDRKDM4EGFER
SCHEMBL15298740 0.72 PTGS1 (0.52) KMT2AMEN1HTTTDP1RECQL
SCHEMBL12916755 0.71 KMT2A (0.59) KMT2AMEN1PDE4ABLVRBKDR
SCHEMBL24093685 0.71 PHLPP2 (0.48) KMT2AMEN1PDE4ABLVRBKDR
SCHEMBL4256125 0.71 PHLPP2 (0.64) KMT2AMEN1PDE4ABLVRBKDR
SCHEMBL11062285 0.71 GLO1 (0.48) KMT2AMEN1PDE4ABLVRBKDR
SCHEMBL4256120 0.71 PHLPP2 (0.64) KMT2AMEN1PDE4ABLVRBKDR

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
US-20160349574-A1 LIQUID-CRYSTAL DISPLAY ELEMENT DIC CORPORATION (JP) 2016-12-01 US disclosed
US-20160306236-A1 LIQUID-CRYSTAL DISPLAY ELEMENT DIC CORPORATION (JP) 2016-10-20 US disclosed