SCHEMBL8587809

SCHEMBL8587809

COc1ccc(N/N=C/C(C)=O)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.51
KMT2A Q03164 5/20 0.51
GAA P10253 5/20 0.51
LMNA P02545 4/20 0.51
MEN1 O00255 4/20 0.51
ALDH1A1 P00352 4/20 0.51
NPSR1 Q6W5P4 2/20 0.51
GFER P55789 1/20 0.51
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
TGM2 P21980 1/20 0.47
KDM4E B2RXH2 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
MITF O75030 1/20 0.47
KLF5 Q13887 1/20 0.47
TP53 P04637 1/20 0.46
ALOX15 P16050 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
HTT P42858 2/20 0.46

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
SCHEMBL8587811 1.00 MAPT (0.51) MAPTKMT2AGAALMNAMEN1
SCHEMBL14058831 0.86 MAPT (0.51) MAPTKMT2AGAALMNAMEN1
SCHEMBL14058830 0.86 MAPT (0.51) MAPTKMT2AGAALMNAMEN1
SCHEMBL8588829 0.82 ACACB (0.39) MAPTKMT2AGAALMNAMEN1
SCHEMBL8588832 0.82 ACACB (0.39) MAPTKMT2AGAALMNAMEN1
SCHEMBL6222383 0.82 MAPT (0.48) MAPTKMT2AGAALMNAMEN1
SCHEMBL5253849 0.81 MAPT (0.47) MAPTKMT2AGAALMNAMEN1
SCHEMBL1144594 0.81 RAB9A (0.53) MAPTKMT2AGAAMEN1ALDH1A1
SCHEMBL5448837 0.80 KYAT1 (0.50) MAPTKMT2AGAALMNAMEN1
SCHEMBL5448834 0.80 KYAT1 (0.50) MAPTKMT2AGAALMNAMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0810864-A4 2,6-DIARYL PYRIDAZINONES WITH IMMUNOSUPPRESSANT ACTIVITY MERCK & CO INC (US) 1998-03-04 EP disclosed
EP-0810864-A1 2,6-DIARYL PYRIDAZINONES WITH IMMUNOSUPPRESSANT ACTIVITY Merck & Co., Inc. (US) 1997-12-10 EP disclosed
US-5670504-A 2,6-diaryl pyridazinones with immunosuppressant activity MERCK & CO. INC. (US) 1997-09-23 US disclosed