SCHEMBL27264126

SCHEMBL27264126

Cn1ncc(Cl)c(N2CCN(CCNc3ccccn3)CC2)c1=O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 9/20 0.50
DRD2 P14416 7/20 0.50
DRD3 P35462 6/20 0.50
ADRA1D P25100 3/20 0.42
ADRA1B P35368 3/20 0.42
DRD1 P21728 1/20 0.40
HTR1A P08908 1/20 0.40
KAT2B Q92831 3/20 0.39
HRH1 P35367 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
SCHEMBL27263295 0.85 ADRA1A (0.55) ADRA1ADRD2DRD3ADRA1DADRA1B
SCHEMBL27263977 0.81 BRD4 (0.41) ADRA1ADRD2ADRA1DADRA1BHTR1A
SCHEMBL27264050 0.81 ADRA1D (0.42) ADRA1AADRA1DADRA1BHTR1AKAT2B
SCHEMBL27263292 0.81 ADRA1A (0.56) ADRA1ADRD2DRD3ADRA1DADRA1B
SCHEMBL27263072 0.80 BPTF (0.46) ADRA1ADRD2ADRA1DADRA1BHTR1A
SCHEMBL27263765 0.80 KAT2B (0.52) ADRA1ADRD3ADRA1DADRA1BHTR1A
SCHEMBL27263873 0.80 ADRA1D (0.52) ADRA1AADRA1DADRA1BHTR1A
SCHEMBL9528850 0.79 BPTF (0.49) ADRA1ADRD2DRD3ADRA1DADRA1B
SCHEMBL27263753 0.79 MAPT (0.44) ADRA1ADRD3ADRA1DADRA1BDRD1
SCHEMBL27263862 0.79 DRD2 (0.49) ADRA1ADRD2DRD3ADRA1DADRA1B

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
CN-1022565-C Process for preparing piperazinylalkyl-3(2H)-pyridazinones CL PHARMA (AT) 1993-10-27 CN disclosed
CN-1043129-A New piperazinyl alkyl-3 (2H)-pyridazinone, its preparation method and as the application of hypotensive agent CL PHARMA (AT) 1990-06-20 CN disclosed