SCHEMBL27673286

SCHEMBL27673286

CCC=CCOc1cnn(CC)c(=O)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.46
KMT2A Q03164 2/20 0.46
BRD4 O60885 1/20 0.39
BPTF Q12830 1/20 0.39
KAT2B Q92831 1/20 0.36
NPBWR1 P48145 1/20 0.34
MCHR1 Q99705 1/20 0.34
ALDH1A1 P00352 10/20 0.34
HTT P42858 8/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
MAPT P10636 3/20 0.34
KDM4E B2RXH2 1/20 0.34
NPSR1 Q6W5P4 6/20 0.33
RAB9A P51151 5/20 0.33
LMNA P02545 4/20 0.33
MITF O75030 3/20 0.33
NPC1 O15118 2/20 0.33
RECQL P46063 2/20 0.33
NR2E3 Q9Y5X4 1/20 0.33
POLB P06746 3/20 0.32

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
SCHEMBL27673287 0.82 GAA (0.45) GAAKMT2ABRD4BPTFKAT2B
SCHEMBL12826267 0.82 GAA (0.53) GAAKMT2ABRD4BPTFKAT2B
SCHEMBL10366469 0.80 GAA (0.50) GAAKMT2ABRD4BPTFKAT2B
SCHEMBL981480 0.77 KMT2A (0.54) GAAKMT2ABRD4BPTFKAT2B
SCHEMBL10368114 0.73 GAA (0.44) GAAKMT2ABRD4BPTFKAT2B
SCHEMBL10616008 0.73 BRD4 (0.43) GAAKMT2ABRD4BPTFNPBWR1
SCHEMBL10858045 0.71 BRD4 (0.44) GAAKMT2ABRD4BPTFKAT2B
SCHEMBL980058 0.70 HTT (0.60) GAAKMT2ABRD4BPTFALDH1A1
SCHEMBL9828927 0.67 GAA (0.57) GAAKMT2ABRD4BPTFKAT2B
Hydrochloric Acid SCHEMBL31607065 0.67 BRD4 (0.47) GAAKMT2ABRD4BPTFKAT2B

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
CN-85108650-A The preparation method of pyridazinone derivative, and insecticidal constituent kill acaricidal composition, and the nematicide composition kills (very) bacterium composition 1986-09-24 CN disclosed