SCHEMBL8114644

SCHEMBL8114644

O=C1CC2CCc3cccnc3C2=NN1c1ccc(Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
HRH1 P35367 7/20 0.35
NSD2 O96028 2/20 0.35
KDM4E B2RXH2 2/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
THRB P10828 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
CASP1 P29466 1/20 0.35
CDC25B P30305 1/20 0.35
RECQL P46063 1/20 0.35
BLM P54132 1/20 0.35
CASP7 P55210 1/20 0.35

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
SCHEMBL8152879 0.93 LMNA (0.37) ALDH1A1MEN1MAPTKMT2ALMNA
SCHEMBL8580696 0.82 ALDH1A1 (0.48) ALDH1A1MEN1MAPTKMT2ALMNA
SCHEMBL8114668 0.82 GABRP (0.41) ALDH1A1MEN1MAPTKMT2ALMNA
SCHEMBL10365811 0.78 MAPT (0.41) ALDH1A1MEN1MAPTKMT2ALMNA
SCHEMBL8124342 0.77 ALDH1A1 (0.39) ALDH1A1MEN1MAPTKMT2ALMNA
SCHEMBL8124757 0.77 ALDH1A1 (0.39) ALDH1A1MEN1MAPTKMT2ALMNA
SCHEMBL10367467 0.75 MAPT (0.44) ALDH1A1MEN1MAPTKMT2ALMNA
SCHEMBL10367579 0.75 PRKCZ (0.41) ALDH1A1MEN1MAPTKMT2ALMNA
SCHEMBL10365659 0.74 GRM5 (0.38) ALDH1A1MEN1MAPTKMT2ALMNA
SCHEMBL7287680 0.74 ALDH1A1 (0.43) ALDH1A1MEN1MAPTKMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1015450-A1 NOVEL PYRIDAZINE COMPOUNDS AstraZeneca UK Limited (GB) 2000-07-05 EP claimed
WO-1997045428-A1 NOVEL PYRIDAZINE COMPOUNDS ASTRA PHARMACEUTICALS LTD. (GB) 1997-12-04 WO claimed
EP-1015450-A1 NOVEL PYRIDAZINE COMPOUNDS AstraZeneca UK Limited (GB) 2000-07-05 EP disclosed
US-5935956-A Pyridazine compounds ASTRA PHARMACEUTICALS LTD. (GB) 1999-08-10 US disclosed
WO-1997045428-A1 NOVEL PYRIDAZINE COMPOUNDS ASTRA PHARMACEUTICALS LTD. (GB) 1997-12-04 WO disclosed